forked from lijiext/lammps
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14735 f3b2605a-c512-4ea7-a41b-209d697bcdaa
This commit is contained in:
sjplimp
parent
f620bcc4f9
commit
109b9bab28
|
|
@ -0,0 +1,121 @@
|
|||
# linux = RedHat Linux box, Intel icc, MPICH2, FFTW
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpiicpc -openmp -DLMP_INTEL_OFFLOAD -DLAMMPS_MEMALIGN=64
|
||||
MIC_OPT = -offload-option,mic,compiler,"-fp-model fast=2 -mGLOB_default_function_attrs=\"gather_scatter_loop_unroll=4\""
|
||||
CCFLAGS = -O3 -xAVX -fno-alias -ansi-alias -restrict -override-limits $(MIC_OPT)
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpiicpc -openmp
|
||||
LINKFLAGS = -O3 -xAVX
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP -DLAMMPS_JPEG
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_MKL -DFFT_SINGLE -I$(MKLROOT)
|
||||
FFT_PATH =
|
||||
FFT_LIB = -L$(MKLROOT) -lmkl_intel_ilp64 -lmkl_intel_thread -lmkl_core
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB = -ljpeg
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,126 @@
|
|||
# bgl = LLNL Blue Gene Light machine, xlC, native MPI, FFTW
|
||||
|
||||
SHELL = /bin/sh
|
||||
.SUFFIXES: .cpp .u
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = /opt/ibmcmp/vacpp/7.0/bin/blrts_xlC
|
||||
CCFLAGS = -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = /opt/ibmcmp/vacpp/7.0/bin/blrts_xlC
|
||||
LINKFLAGS = -O \
|
||||
-L/opt/ibmcmp/xlf/9.1/blrts_lib \
|
||||
-L/opt/ibmcmp/vacpp/7.0/blrts_lib \
|
||||
-L/bgl/local/lib \
|
||||
-L/bgl/local/bglfftwgel-2.1.5.pre5/lib
|
||||
LIB = -lxlopt -lxlomp_ser -lxl -lxlfmath -lm \
|
||||
-lmsglayer.rts -lrts.rts -ldevices.rts -lmassv
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX
|
||||
MPI_PATH =
|
||||
MPI_LIB = -lmpich.rts
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_FFTW
|
||||
FFT_PATH =
|
||||
FFT_LIB = -lfftw
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,61 @@
|
|||
# bgq = IBM Blue Gene/Q, multiple compiler options, native MPI, ALCF FFTW2
|
||||
|
||||
SHELL = /bin/bash
|
||||
.SUFFIXES: .cpp .u
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
# select which compiler by editing Makefile.bgq.details
|
||||
|
||||
include ../MAKE/Makefile.bgq.details
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,125 @@
|
|||
# multiple compiler options for BGQ
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
# uncomment one and only one of the following three lines
|
||||
# to choose a compiler toolchain
|
||||
|
||||
#COMPILER = GCC
|
||||
#COMPILER = LLVM
|
||||
COMPILER = XLC
|
||||
|
||||
ifeq ($(COMPILER),XLC)
|
||||
CC = /bgsys/drivers/ppcfloor/comm/xl.ndebug/bin/mpixlcxx_r
|
||||
CCFLAGS = -O3 -qarch=qp -qtune=qp -qsmp=omp -qsimd=auto -qhot=level=2 -qprefetch -qunroll=yes
|
||||
FC = /bgsys/drivers/ppcfloor/comm/xl.ndebug/bin/mpixlf90_r
|
||||
FFLAGS = -O3 -qarch=qp -qtune=qp -qsimd=auto -qhot=level=2 -qprefetch -qunroll=yes -qsmp=omp -qextname -qnosave
|
||||
DEPFLAGS = -M -qmakedep=gcc
|
||||
endif
|
||||
|
||||
ifeq ($(COMPILER),GCC)
|
||||
CC = /bgsys/drivers/ppcfloor/comm/gcc.legacy/bin/mpicxx
|
||||
CCFLAGS = -O3 -fopenmp
|
||||
FC = /bgsys/drivers/ppcfloor/comm/gcc.legacy/bin/mpif90
|
||||
FFLAGS = -O3 -fopenmp
|
||||
DEPFLAGS = -M
|
||||
endif
|
||||
|
||||
ifeq ($(COMPILER),LLVM)
|
||||
#CC = bgclang++
|
||||
CC = /home/projects/llvm/mpi/bgclang/bin/mpiclang++
|
||||
CCFLAGS = -O3 -fopenmp
|
||||
DEPFLAGS = -M
|
||||
FC = /bin/false
|
||||
FFLAGS = LLVM does not have a Fortran front-end!
|
||||
endif
|
||||
|
||||
LINK = $(CC)
|
||||
LINKFLAGS = $(CCFLAGS)
|
||||
|
||||
ifeq ($(COMPILER),XLC)
|
||||
MASS_LIB = ${IBM_MAIN_DIR}/xlmass/bg/7.3/bglib64
|
||||
XLF_LIB = ${IBM_MAIN_DIR}/xlf/bg/14.1/bglib64
|
||||
XLSMP_LIB = ${IBM_MAIN_DIR}/xlsmp/bg/3.1/bglib64
|
||||
LIB += -L${MASS_LIB} -L${XLF_LIB} -L${XLSMP_LIB}
|
||||
LIB += -lmassv -lmass
|
||||
LIB += -lxlf90_r -lxlsmp -lxlopt -lxlfmath -lxl
|
||||
endif
|
||||
|
||||
ifeq ($(COMPILER),GCC)
|
||||
# libm is definitely slower than libmass...
|
||||
LIB += -lm -lgfortran
|
||||
endif
|
||||
|
||||
ifeq ($(COMPILER),LLVM)
|
||||
SLEEF_DIR = /home/projects/llvm/sleef
|
||||
LIB += -L${SLEEF_DIR}/lib -lsleef
|
||||
endif
|
||||
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
|
||||
# BGQ should not use shared libraries
|
||||
|
||||
SHFLAGS =
|
||||
SHLIBFLAGS =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC =
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
MPI_INC += -DMPICH_SKIP_MPICXX
|
||||
MPI_LIB += #/home/jhammond/OSPRI/branches/marpn/wrap/libmpiarbrpn.a
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -I/soft/libraries/alcf/current/xl/FFTW2/include -DFFT_FFTW -DFFTW_SIZE
|
||||
FFT_PATH = #/soft/libraries/alcf/current/xl/FFTW2
|
||||
FFT_LIB = -L/soft/libraries/alcf/current/xl/FFTW2/lib -ldfftw
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# chama - Intel SandyBridge, mpic++, openmpi, no FFTW
|
||||
|
||||
# need to load the following modules:
|
||||
# 1) intel/12.1
|
||||
# 2) openmpi-intel/1.4
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpic++
|
||||
CCFLAGS = -O3 -axAVX -funroll-loops -fstrict-aliasing -openmp
|
||||
DEPFLAGS = -M
|
||||
LINK = mpic++
|
||||
LINKFLAGS = -O3 -axAVX -openmp
|
||||
LIB = -lstdc++
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rcsv
|
||||
SIZE = size
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC =
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
#FFT_INC = -DFFT_FFTW -I${FFTW_INCLUDE}
|
||||
#FFT_PATH = -L${FFTW_LIB}
|
||||
#FFT_LIB = -lfftw
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# cygwin = Windows Cygwin, mpicxx, MPICH, FFTW
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpicxx
|
||||
CCFLAGS = -O
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpicxx
|
||||
LINKFLAGS = -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX
|
||||
MPI_PATH = -L/cygdrive/c/cygwin/mpich2-1.0.4p1/lib
|
||||
MPI_LIB = -lmpich
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_FFTW -I/cygdrive/c/cygwin/usr/local/include
|
||||
FFT_PATH = -L/cygdrive/c/cygwin/usr/local/lib
|
||||
FFT_LIB = -lfftw
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,137 @@
|
|||
# glory = Linux cluster with 4-way quad cores, Intel mpicxx, native MPI, FFTW
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# this Makefile builds LAMMPS for mvapich running on Glory
|
||||
# to invoke this Makefile, you need these modules loaded:
|
||||
# compilers/intel-11.1-f064-c064
|
||||
# mpi/mvapich-1.1_intel-11.1-f064-c064
|
||||
# libraries/fftw-2.1.5
|
||||
# you can determine which modules are loaded by typing:
|
||||
# module list
|
||||
# these modules are not the default ones, but can be enabled by
|
||||
# lines like this in your .cshrc or other start-up shell file
|
||||
# or by typing them before you build LAMMPS:
|
||||
# module swap mpi misc/env-mvapich
|
||||
# module load compilers/intel-11.1-f064-c064
|
||||
# module load mpi/mvapich-1.1_intel-11.1-f064-c064
|
||||
# module load libraries/fftw-2.1.5
|
||||
# these same modules need to be loaded to submit a LAMMPS job,
|
||||
# either interactively or via a batch script
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpicxx
|
||||
CCFLAGS = -O
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpicxx
|
||||
LINKFLAGS = -O
|
||||
LIB = -lstdc++ -lm
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC =
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_FFTW -I${FFTW_INCLUDE}
|
||||
FFT_PATH = -L${FFTW_LIB}
|
||||
FFT_LIB = -lfftw
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# jaguar = ORNL Jaguar Cray XT5, CC, native MPICH, FFTW
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CXX = CC
|
||||
CCFLAGS = -g -O
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = $(CXX)
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP -DNODE_PARTITION
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX
|
||||
MPI_PATH =
|
||||
MPI_LIB = -lmpich -lpthread
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_FFTW3 -I$(FFTW_INC)
|
||||
FFT_PATH = -L$(FFTW_DIR)
|
||||
FFT_LIB = -lfftw3
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# mac = Apple PowerBook G4 laptop, c++, no MPI, FFTW 2.1.5
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = c++
|
||||
CCFLAGS = -O
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = c++
|
||||
LINKFLAGS = -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -I../STUBS
|
||||
MPI_PATH = -L../STUBS
|
||||
MPI_LIB = -lmpi_stubs
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_FFTW
|
||||
FFT_PATH =
|
||||
FFT_LIB = -lfftw
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,123 @@
|
|||
# mac_mpi = Apple laptop, MacPorts Open MPI 1.4.3, gcc 4.8, fftw, jpeg
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# generally no need to edit this section
|
||||
# unless additional compiler/linker flags or libraries needed for your machine
|
||||
|
||||
CC = /opt/local/bin/mpicxx-openmpi-mp
|
||||
CCFLAGS = -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = /opt/local/bin/mpicxx-openmpi-mp
|
||||
LINKFLAGS = -O3
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP -DLAMMPS_JPEG
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DOMPI_SKIP_MPICXX
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFTW = /usr/local
|
||||
|
||||
FFT_INC = -DFFT_FFTW -I${FFTW}/include
|
||||
FFT_PATH = -L${FFTW}/lib
|
||||
FFT_LIB = -lfftw
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC = -I/opt/local/include
|
||||
JPG_PATH = -L/opt/local/lib
|
||||
JPG_LIB = -ljpeg
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,125 @@
|
|||
# mingw32-cross = Win 32-bit, gcc-4.7.1, MinGW, internal FFT, no MPI, OpenMP
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = i686-w64-mingw32-g++
|
||||
CCFLAGS = -O3 -march=i686 -mtune=generic -mfpmath=387 -mpc64 -fopenmp \
|
||||
-ffast-math -fstrict-aliasing -Wall -W -Wno-uninitialized
|
||||
|
||||
SHFLAGS = # -fPIC (not needed on windows, all code is PIC)
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = i686-w64-mingw32-g++ -static
|
||||
LINKFLAGS = -O2 -march=i686 -mtune=generic -mfpmath=387 -mpc64 -fopenmp
|
||||
LIB = -lwsock32 -static-libgcc -lquadmath -lpsapi
|
||||
SIZE = i686-w64-mingw32-size
|
||||
|
||||
ARCHIVE = i686-w64-mingw32-ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# name of object file subdir for libraries in lib with leading '/'
|
||||
LIBOBJDIR = /Obj_mingw32
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_SMALLSMALL -DLAMMPS_JPEG -DLAMMPS_PNG -DLAMMPS_XDR -DLAMMPS_GZIP -DLAMMPS_FFMPEG
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -I../STUBS
|
||||
MPI_PATH = -L../STUBS
|
||||
MPI_LIB = -lmpi_mingw32
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manual
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB = -ljpeg -lpng -lz
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,125 @@
|
|||
# mingw32-cross-mpi = Win 32-bit, gcc-4.7.1, MinGW, internal FFT, MPICH2, OpenMP
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = i686-w64-mingw32-g++
|
||||
CCFLAGS = -O3 -march=i686 -mtune=generic -mfpmath=387 -mpc64 -fopenmp \
|
||||
-ffast-math -fstrict-aliasing -Wall -W -Wno-uninitialized
|
||||
|
||||
SHFLAGS = # -fPIC (not needed on windows, all code is PIC)
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = i686-w64-mingw32-g++ -static
|
||||
LINKFLAGS = -O2 -march=i686 -mtune=generic -mfpmath=387 -mpc64 -fopenmp
|
||||
LIB = -lwsock32 -static-libgcc -lquadmath -lpsapi
|
||||
SIZE = i686-w64-mingw32-size
|
||||
|
||||
ARCHIVE = i686-w64-mingw32-ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# name of object file subdir for libraries in lib with leading '/'
|
||||
LIBOBJDIR = /Obj_mingw32-mpi
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_SMALLSMALL -DLAMMPS_JPEG -DLAMMPS_PNG -DLAMMPS_XDR -DLAMMPS_GZIP -DLAMMPS_FFMPEG
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -I../../tools/mingw-cross/mpich2-win32/include -DMPICH_SKIP_MPICXX
|
||||
MPI_PATH = -L../../tools/mingw-cross/mpich2-win32/lib
|
||||
MPI_LIB = -lmpi
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manual
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB = -ljpeg -lpng -lz
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,125 @@
|
|||
# mingw64-cross = Win 64-bit, gcc-4.7.1, MinGW, internal FFT, no MPI, OpenMP
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = x86_64-w64-mingw32-g++
|
||||
CCFLAGS = -O3 -march=core2 -mtune=core2 -mpc64 -msse2 -fopenmp \
|
||||
-ffast-math -fstrict-aliasing -Wall -W -Wno-uninitialized
|
||||
|
||||
SHFLAGS = # -fPIC (not needed on windows, all code is PIC)
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = x86_64-w64-mingw32-g++ -static
|
||||
LINKFLAGS = -O2 -march=core2 -mtune=core2 -mpc64 -msse2 -fopenmp
|
||||
LIB = -lwsock32 -static-libgcc -lquadmath -lpsapi
|
||||
SIZE = x86_64-w64-mingw32-size
|
||||
|
||||
ARCHIVE = x86_64-w64-mingw32-ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# name of object file subdir for libraries in lib with leading '/'
|
||||
LIBOBJDIR = /Obj_mingw64
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_SMALLBIG -DLAMMPS_JPEG -DLAMMPS_PNG -DLAMMPS_XDR -DLAMMPS_GZIP -DLAMMPS_FFMPEG
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -I../STUBS
|
||||
MPI_PATH = -L../STUBS
|
||||
MPI_LIB = -lmpi_mingw64
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manual
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB = -ljpeg -lpng -lz
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,125 @@
|
|||
# mingw64-cross-mpi = Win 64-bit, gcc-4.7.1, MinGW, internal FFT, MPICH2, OpenMP
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = x86_64-w64-mingw32-g++
|
||||
CCFLAGS = -O3 -march=core2 -mtune=core2 -mpc64 -msse2 -fopenmp \
|
||||
-ffast-math -fstrict-aliasing -Wall -W -Wno-uninitialized
|
||||
|
||||
SHFLAGS = # -fPIC (not needed on windows, all code is PIC)
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = x86_64-w64-mingw32-g++ -static
|
||||
LINKFLAGS = -O2 -march=core2 -mtune=core2 -mpc64 -msse2 -fopenmp
|
||||
LIB = -lwsock32 -static-libgcc -lquadmath -lpsapi
|
||||
SIZE = x86_64-w64-mingw32-size
|
||||
|
||||
ARCHIVE = x86_64-w64-mingw32-ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# name of object file subdir for libraries in lib with leading '/'
|
||||
LIBOBJDIR = /Obj_mingw64-mpi
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_SMALLBIG -DLAMMPS_JPEG -DLAMMPS_PNG -DLAMMPS_XDR -DLAMMPS_GZIP -DLAMMPS_FFMPEG
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -I../../tools/mingw-cross/mpich2-win64/include -DMPICH_SKIP_MPICXX
|
||||
MPI_PATH = -L../../tools/mingw-cross/mpich2-win64/lib
|
||||
MPI_LIB = -lmpi
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manual
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB = -ljpeg -lpng -lz
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# myrinet = cluster, g++, myrinet MPI, no FFTs
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = g++
|
||||
CCFLAGS = -O
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = G++
|
||||
LINKFLAGS = -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -I/opt/mpich-mx/include
|
||||
MPI_PATH = -L/opt/mpich-mx/lib -L/opt/mx/lib
|
||||
MPI_LIB = -lmpich -lmyriexpress
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_NONE
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,121 @@
|
|||
# power = IBM Power5+, mpCC_r, native MPI, FFTW
|
||||
|
||||
SHELL = /bin/sh
|
||||
.SUFFIXES: .cpp .u
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpCC_r
|
||||
CCFLAGS = -O3 -qnoipa -qlanglvl=oldmath
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpCC_r
|
||||
LINKFLAGS = -O -qnoipa -qlanglvl=oldmath -bmaxdata:0x70000000
|
||||
LIB = -lm
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC =
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_FFTW -I/scr/oppe/LAMMPS/fftw-2.1.5/include
|
||||
FFT_PATH = -L/scr/oppe/LAMMPS/fftw-2.1.5/lib
|
||||
FFT_LIB = -lfftw
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,140 @@
|
|||
# redsky - SUN X6275 nodes, Nehalem procs, mpic++, openmpi, OpenMP, no FFTW
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# This Makefile builds LAMMPS for RedSky with OpenMPI.
|
||||
# To use this Makefile, you need appropriate modules loaded.
|
||||
# You can determine which modules are loaded by typing:
|
||||
# module list
|
||||
# These modules can be enabled by lines like this in your .cshrc or
|
||||
# other start-up shell file or by typing them before you build LAMMPS:
|
||||
# module load mpi/openmpi-1.4.2_oobpr_intel-11.1-f064-c064
|
||||
# module load libraries/intel-mkl-11.1.064
|
||||
# module load libraries/fftw-2.1.5_openmpi-1.4.2_oobpr_intel-11.1-f064-c064
|
||||
# These same modules need to be loaded to submit a LAMMPS job,
|
||||
# either interactively or via a batch script.
|
||||
|
||||
# IMPORTANT NOTE:
|
||||
# to run efficiently on RedSky, use the "numa_wrapper" mpiexec option,
|
||||
# to insure proceses and their memory are locked to specific cores
|
||||
# e.g. in your batch script:
|
||||
# nodes=$SLURM_JOB_NUM_NODES
|
||||
# cores=8
|
||||
# mpiexec --npernode $cores numa_wrapper --ppn $cores lmp_redsky < in > out
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpic++ -fopenmp
|
||||
CCFLAGS = -O2 -xsse4.2 -funroll-loops -fstrict-aliasing
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpic++ -fopenmp
|
||||
LINKFLAGS = -O -xsse4.2
|
||||
LIB = -lstdc++
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rcsv
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC =
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
#FFT_INC = -DFFT_FFTW -I${FFTW_INCLUDE}
|
||||
#FFT_PATH = -L${FFTW_LIB}
|
||||
#FFT_LIB = -lfftw
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# serial = RedHat Linux box, g++4, no MPI, no FFTs
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = g++
|
||||
CCFLAGS = -O
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = g++
|
||||
LINKFLAGS = -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -I../STUBS
|
||||
MPI_PATH = -L../STUBS
|
||||
MPI_LIB = -lmpi_stubs
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,119 @@
|
|||
# stampede = Intel Compiler, MKL FFT, Offload to Xeon Phi
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpicc -openmp -DLMP_INTEL_OFFLOAD -DLAMMPS_MEMALIGN=64
|
||||
MIC_OPT = -offload-option,mic,compiler,"-fp-model fast=2 -mGLOB_default_function_attrs=\"gather_scatter_loop_unroll=4\""
|
||||
CCFLAGS = -O3 -xhost -fp-model precise -restrict -override-limits $(MIC_OPT)
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpicc -openmp
|
||||
LINKFLAGS = -O3 -xhost
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_MKL -I$(TACC_MKL_INC)
|
||||
FFT_PATH =
|
||||
FFT_LIB = -L$(TACC_MKL_LIB) -lmkl_intel_ilp64 -lmkl_intel_thread -lmkl_core
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB = -ljpeg
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,121 @@
|
|||
# storm = Cray Red Storm XT3, Cray CC, native MPI, FFTW
|
||||
|
||||
SHELL = /bin/sh
|
||||
.SUFFIXES: .cpp .d
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = CC
|
||||
CCFLAGS = -fastsse
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = CC
|
||||
LINKFLAGS = -O
|
||||
LIB = -lstdc++
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_FFTW -I/projects/fftw/fftw-2.1.5/include
|
||||
FFT_PATH =
|
||||
FFT_LIB = -lfftw
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,123 @@
|
|||
# tacc = UT Lonestar TACC machine, mpiCC, MPI, FFTW
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpiCC
|
||||
CCFLAGS = -O
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpiCC
|
||||
LINKFLAGS = -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX
|
||||
MPI_PATH =
|
||||
MPI_LIB = -lmpich -lpthread
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFTW_INC = ${TACC_FFTW2_INC}
|
||||
FFTW_LIB = ${TACC_FFTW2_LIB}
|
||||
|
||||
FFT_INC = -DFFT_FFTW -I${FFTW_INC}
|
||||
FFT_PATH = -L${FFTW_LIB}
|
||||
FFT_LIB = ${FFTW_LIB}/libfftw.a
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,124 @@
|
|||
# ubuntu = Ubuntu Linux box, g++, openmpi, FFTW3
|
||||
|
||||
# you have to install the packages g++, mpi-default-bin, mpi-default-dev,
|
||||
# libfftw3-dev, libjpeg-dev and libpng12-dev to compile LAMMPS with this
|
||||
# makefile
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpic++
|
||||
CCFLAGS = -g -O3 # -Wunused
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpic++
|
||||
LINKFLAGS = -g -O3
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP -DLAMMPS_JPEG -DLAMMPS_PNG -DLAMMPS_FFMPEG
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC =
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_FFTW3
|
||||
FFT_PATH =
|
||||
FFT_LIB = -lfftw3
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB = -ljpeg -lpng
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,123 @@
|
|||
# ubuntu_simple = Ubuntu Linux box, g++, openmpi, KISS FFT
|
||||
|
||||
# you have to install the packages g++, mpi-default-bin and mpi-default-dev
|
||||
# to compile LAMMPS with this makefile
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpic++
|
||||
CCFLAGS = -g -O3 # -Wunused
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpic++
|
||||
LINKFLAGS = -g -O3
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC =
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,121 @@
|
|||
# xe6 = Cray XE6, Cray CC, native MPI, FFTW
|
||||
|
||||
SHELL = /bin/sh
|
||||
.SUFFIXES: .cpp .d
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = CC
|
||||
CCFLAGS = -fastsse
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = CC
|
||||
LINKFLAGS = -O
|
||||
LIB = -lstdc++
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_FFTW
|
||||
FFT_PATH =
|
||||
FFT_LIB = -lfftw
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,122 @@
|
|||
# xt3 = PSC BigBen Cray XT3, CC, native MPI, FFTW
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = CC
|
||||
CCFLAGS = -O3 --target=catamount \
|
||||
-fomit-frame-pointer -finline-functions \
|
||||
-Wall -Wno-unused -funroll-all-loops
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = CC
|
||||
LINKFLAGS = --target=catamount -O
|
||||
LIB = -lgmalloc
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP -DLAMMPS_XDR
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX
|
||||
MPI_PATH =
|
||||
MPI_LIB = -lmpich -lpthread
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_FFTW -I$(FFTW_INC)
|
||||
FFT_PATH = -L$(FFTW_LIB)
|
||||
FFT_LIB = -ldfftw
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,121 @@
|
|||
# xt5 = Cray XT5, Cray CC, native MPI, FFTW
|
||||
|
||||
SHELL = /bin/sh
|
||||
.SUFFIXES: .cpp .d
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = CC
|
||||
CCFLAGS = -fastsse
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = CC
|
||||
LINKFLAGS = -O
|
||||
LIB = -lstdc++
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_FFTW -I/home/sjplimp/fftw/fftw
|
||||
FFT_PATH = -L/home/sjplimp/fftw/fftw/.libs
|
||||
FFT_LIB = -lfftw
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# auto = makefile auto-generated by Make.py
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = g++
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = g++
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP -DLAMMPS_JPEG
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1 -I/usr/local/include
|
||||
MPI_PATH = -L/usr/local/lib
|
||||
MPI_LIB = -lmpich -lmpl -lpthread
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_FFTW3
|
||||
FFT_PATH =
|
||||
FFT_LIB = -lfftw3
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB = -ljpeg
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# g++ = g++ compiler, native MPICH w/out wrapper
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = g++
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = g++
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP -DLAMMPS_JPEG
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1 -I/usr/local/include
|
||||
MPI_PATH = -L/usr/local/lib
|
||||
MPI_LIB = -lmpich -lmpl -lpthread
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_FFTW3
|
||||
FFT_PATH =
|
||||
FFT_LIB = -lfftw3
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB = -ljpeg
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# icc = icc compiler, native MPICH w/out wrapper
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = icc
|
||||
CCFLAGS = -g -O3 -restrict --std=c++11
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = icc
|
||||
LINKFLAGS = -g -O --std=c++11
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP -DLAMMPS_JPEG
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1 -I/usr/local/include
|
||||
MPI_PATH = -L/usr/local/lib
|
||||
MPI_LIB = -lmpich -lmpl -lpthread
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_FFTW3
|
||||
FFT_PATH =
|
||||
FFT_LIB = -lfftw3
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB = -ljpeg
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,121 @@
|
|||
# openmpi_g++ = g++ compiler, native OpenMPI w/out wrapper
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = g++
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = g++
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1 \
|
||||
-I/usr/local/openmpi/include
|
||||
MPI_PATH = -L/usr/local/openmpi/lib
|
||||
MPI_LIB = -lmpi -lmpi_cxx
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,121 @@
|
|||
# openmpi_icc = icc compiler, native OpenMPI w/out wrapper
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = icc
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = icc
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1 \
|
||||
-I/usr/local/openmpi/include
|
||||
MPI_PATH = -L/usr/local/openmpi/lib
|
||||
MPI_LIB = -lmpi -lmpi_cxx
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# mpi = default MPI compiler, default MPI
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpicxx
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpicxx
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manual
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,115 @@
|
|||
# mpi = default MPI compiler, default MPI
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpicxx
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpicxx
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manual
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
DEPENDS = $(OBJ:.o=.d)
|
||||
sinclude $(DEPENDS)
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# serial = g++ compiler, no MPI, internal FFT
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = g++
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = g++
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -I../STUBS
|
||||
MPI_PATH = -L../STUBS
|
||||
MPI_LIB = -lmpi_stubs
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,115 @@
|
|||
# serial = g++ compiler, no MPI, internal FFT
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = g++
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = g++
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -I../STUBS
|
||||
MPI_PATH = -L../STUBS
|
||||
MPI_LIB = -lmpi_stubs
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
DEPENDS = $(OBJ:.o=.d)
|
||||
sinclude $(DEPENDS)
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# fftw = default MPI compiler, default MPI, FFTW support
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpicxx
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpicxx
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manual
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_FFTW3 -I/usr/local/include
|
||||
FFT_PATH = -L/usr/local/lib
|
||||
FFT_LIB = -lfftw3
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,123 @@
|
|||
# intel_cpu = USER-INTEL package with CPU optimizations, Intel MPI, MKL FFT
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpiicpc
|
||||
OPTFLAGS = -xHost -O2 -fp-model fast=2 -no-prec-div -override-limits
|
||||
CCFLAGS = -g -openmp -DLAMMPS_MEMALIGN=64 -no-offload \
|
||||
-fno-alias -ansi-alias -restrict $(OPTFLAGS)
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpiicpc
|
||||
LINKFLAGS = -g -openmp $(OPTFLAGS)
|
||||
LIB = -ltbbmalloc
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP -DLAMMPS_JPEG
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_MKL -DFFT_SINGLE
|
||||
FFT_PATH =
|
||||
FFT_LIB = -L$MKLROOT/lib/intel64/ -lmkl_intel_ilp64 \
|
||||
-lmkl_intel_thread -lmkl_core
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB = -ljpeg
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# intel_knl = USER-INTEL package build for "Knights Landing" processors, Intel MPI, MKL FFT
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpiicpc
|
||||
CCFLAGS = -g -O2 -openmp -DLAMMPS_MEMALIGN=64 -no-offload -fp-model fast=2 \
|
||||
-xMIC-AVX512 -fno-alias -ansi-alias -restrict -override-limits
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpiicpc
|
||||
LINKFLAGS = -g -O2 -openmp -xMIC-AVX512
|
||||
LIB = -ltbbmalloc
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP -DLAMMPS_JPEG
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_MKL -DFFT_SINGLE
|
||||
FFT_PATH =
|
||||
FFT_LIB = -L$MKLROOT/lib/intel64/ -lmkl_intel_ilp64 \
|
||||
-lmkl_intel_thread -lmkl_core
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB = -ljpeg
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,123 @@
|
|||
# intel_phi = USER-INTEL package with Phi offload support, Intel MPI, MKL FFT
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpiicpc
|
||||
MIC_OPT = -offload-option,mic,compiler,"-fp-model fast=2 -mGLOB_default_function_attrs=\"gather_scatter_loop_unroll=4\""
|
||||
CCFLAGS = -g -O3 -openmp -DLMP_INTEL_OFFLOAD -DLAMMPS_MEMALIGN=64 \
|
||||
-xHost -fno-alias -ansi-alias -restrict \
|
||||
-override-limits $(MIC_OPT)
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpiicpc
|
||||
LINKFLAGS = -g -O3 -xHost -openmp -offload
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP -DLAMMPS_JPEG
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_MKL -DFFT_SINGLE
|
||||
FFT_PATH =
|
||||
FFT_LIB = -L$(MKLROOT)/lib/intel64/ -lmkl_intel_ilp64 -lmkl_intel_thread -lmkl_core
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB = -ljpeg
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# jpeg = default MPI compiler, default MPI, JPEG support
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpicxx
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpicxx
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP -DLAMMPS_JPEG
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manual
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC = -I/usr/include
|
||||
JPG_PATH = -L/usr/lib
|
||||
JPG_LIB = -ljpeg
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,121 @@
|
|||
# knl = Flags for Knights Landing Xeon Phi Processor,Intel Compiler/MPI,MKL FFT
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpiicpc
|
||||
OPTFLAGS = -xMIC-AVX512 -O2 -fp-model fast=2 -no-prec-div -override-limits
|
||||
CCFLAGS = -g -openmp -DLAMMPS_MEMALIGN=64 -no-offload \
|
||||
-fno-alias -ansi-alias -restrict $(OPTFLAGS)
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpiicpc
|
||||
LINKFLAGS = -g -openmp $(OPTFLAGS) -static-intel
|
||||
LIB = -ltbbmalloc
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP -DLAMMPS_JPEG
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_MKL -DFFT_SINGLE
|
||||
FFT_PATH =
|
||||
FFT_LIB = -L$MKLROOT/lib/intel64/ -lmkl_intel_ilp64 \
|
||||
-lmkl_intel_thread -lmkl_core
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB = -ljpeg
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,125 @@
|
|||
# kokkos_cuda = KOKKOS package with CUDA support, OpenMPI, nvcc/mpicxx compiler
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
KOKKOS_ABSOLUTE_PATH = $(shell cd $(KOKKOS_PATH); pwd)
|
||||
export OMPI_CXX = $(KOKKOS_ABSOLUTE_PATH)/config/nvcc_wrapper
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpicxx
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpicxx
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
KOKKOS_DEVICES = Cuda, OpenMP
|
||||
KOKKOS_ARCH = Kepler35
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,121 @@
|
|||
# kokkos_omp = KOKKOS package with OMP support, MPI compiler, default MPI
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpicxx
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpicxx
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
KOKKOS_DEVICES = OpenMP
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manual
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,122 @@
|
|||
# kokkos_phi = KOKKOS package with PHI support, Intel compiler, default MPI
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpiicpc
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpiicpc
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
KOKKOS_DEVICES = OpenMP
|
||||
KOKKOS_ARCH = KNC
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manual
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,118 @@
|
|||
# mpi_fastmgpt = default MPI compiler, default MPI, optimizations for USER-MGPT
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpicxx
|
||||
CCFLAGS = -O3 -msse3 -funroll-loops
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpicxx
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manual
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# mpich_g++ = g++ compiler and MPICH via MPI wrapper
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpicxx -cxx=g++
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpicxx -cxx=g++
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# mpich_icc = icc compiler and MPICH via MPI wrapper
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpicxx -cxx=icc
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpicxx -cxx=icc
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# mpich_native_g++ = g++ compiler, native MPICH w/out wrapper
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = g++
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = g++
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1 -I/usr/local/include
|
||||
MPI_PATH = -L/usr/local/lib
|
||||
MPI_LIB = -lmpich -lmpl -lpthread
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# mpich_native_icc = icc compiler, native MPICH w/out wrapper
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = icc
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = icc
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1 -I/usr/local/include
|
||||
MPI_PATH = -L/usr/local/lib
|
||||
MPI_LIB = -lmpich -lmpl -lpthread
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# omp = USER-OMP package with default MPI compiler, default MPI
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpicxx
|
||||
CCFLAGS = -g -O3 -restrict -fopenmp
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpicxx
|
||||
LINKFLAGS = -g -O -fopenmp
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manual
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,121 @@
|
|||
# ompi_g++ = g++ compiler and OpenMPI via MPI wrapper
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
OMPI_CXX := g++
|
||||
CC = mpicxx
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpicxx
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,121 @@
|
|||
# ompi_icc = icc compiler and OpenMPI via MPI wrapper
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
OMPI_CXX := icc
|
||||
CC = mpicxx
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpicxx
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# ompi_native_g++ = g++ compiler, native OpenMPI w/out wrapper
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = g++
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = g++
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1 -I/usr/local/include
|
||||
MPI_PATH = -L/usr/local/lib
|
||||
MPI_LIB = -lmpi -lmpi_cxx
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# ompi_native_icc = icc compiler, native OpenMPI w/out wrapper
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = icc
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = icc
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1 -I/usr/local/include
|
||||
MPI_PATH = -L/usr/local/lib
|
||||
MPI_LIB = -lmpi -lmpi_cxx
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# opt = OPT package with default MPI compiler, default MPI
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpicxx
|
||||
CCFLAGS = -g -O3 -restrict
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpicxx
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manual
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,121 @@
|
|||
# pgi = Portland Group compiler pgCC, MPICH, FFTW
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = pgCC
|
||||
CCFLAGS = -g -fast
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = pgCC
|
||||
LINKFLAGS = -g
|
||||
LIB =
|
||||
#LIB = -lstdc++
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -I/usr/local/mpich-1.2.6/pg/include
|
||||
MPI_PATH = -L/usr/local/mpich-1.2.6/pg/lib
|
||||
MPI_LIB = -lmpich
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_FFTW3
|
||||
FFT_PATH =
|
||||
FFT_LIB = -lfftw3
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# png = default MPI compiler, default MPI, PNG support
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = mpicxx
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = mpicxx
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP -DLAMMPS_PNG
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -DMPICH_SKIP_MPICXX -DOMPI_SKIP_MPICXX=1
|
||||
MPI_PATH =
|
||||
MPI_LIB =
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manual
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC = -I/usr/include
|
||||
JPG_PATH = -L/usr/lib
|
||||
JPG_LIB = -lpng
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,120 @@
|
|||
# serial_icc = icc compiler, no MPI
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = icc
|
||||
CCFLAGS = -g -O3
|
||||
SHFLAGS = -fPIC
|
||||
DEPFLAGS = -M
|
||||
|
||||
LINK = icc
|
||||
LINKFLAGS = -g -O
|
||||
LIB =
|
||||
SIZE = size
|
||||
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SHLIBFLAGS = -shared
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings, all OPTIONAL
|
||||
# specify settings for LAMMPS features you will use
|
||||
# if you change any -D setting, do full re-compile after "make clean"
|
||||
|
||||
# LAMMPS ifdef settings
|
||||
# see possible settings in Section 2.2 (step 4) of manual
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library
|
||||
# see discussion in Section 2.2 (step 5) of manual
|
||||
# MPI wrapper compiler/linker can provide this info
|
||||
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||
# use -D MPICH and OMPI settings in INC to avoid C++ lib conflicts
|
||||
# INC = path for mpi.h, MPI compiler settings
|
||||
# PATH = path for MPI library
|
||||
# LIB = name of MPI library
|
||||
|
||||
MPI_INC = -I../STUBS
|
||||
MPI_PATH = -L../STUBS
|
||||
MPI_LIB = -lmpi_stubs
|
||||
|
||||
# FFT library
|
||||
# see discussion in Section 2.2 (step 6) of manaul
|
||||
# can be left blank to use provided KISS FFT library
|
||||
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC =
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# JPEG and/or PNG library
|
||||
# see discussion in Section 2.2 (step 7) of manual
|
||||
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||
# INC = path(s) for jpeglib.h and/or png.h
|
||||
# PATH = path(s) for JPEG library and/or PNG library
|
||||
# LIB = name(s) of JPEG library and/or PNG library
|
||||
|
||||
JPG_INC =
|
||||
JPG_PATH =
|
||||
JPG_LIB =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# do not edit this section
|
||||
|
||||
include Makefile.package.settings
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||
EXTRA_CPP_DEPENDS = $(PKG_CPP_DEPENDS)
|
||||
EXTRA_LINK_DEPENDS = $(PKG_LINK_DEPENDS)
|
||||
|
||||
# Path to src files
|
||||
|
||||
vpath %.cpp ..
|
||||
vpath %.h ..
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library targets
|
||||
|
||||
lib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
shlib: $(OBJ) $(EXTRA_LINK_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
%.o:%.cu $(EXTRA_CPP_DEPENDS)
|
||||
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
depend : fastdep.exe $(SRC)
|
||||
@./fastdep.exe $(EXTRA_INC) -- $^ > .depend || exit 1
|
||||
|
||||
fastdep.exe: ../DEPEND/fastdep.c
|
||||
cc -O -o $@ $<
|
||||
|
||||
sinclude .depend
|
||||
|
|
@ -0,0 +1,106 @@
|
|||
This directory and its sub-directories contain machine Makefiles for
|
||||
LAMMPS. The use of machine Makefiles and their settings are discussed
|
||||
in Section 2 of the manual.
|
||||
|
||||
If you are new to LAMMPS, try one of the files in this directory
|
||||
first.
|
||||
|
||||
Then you can try files in the sub-directories with more options you
|
||||
may need, or that are specific to a machine you are running on.
|
||||
|
||||
If none of the existing files work, you can edit a file in either
|
||||
directory to create your own customized Makefile.machine. Put it in
|
||||
the MINE directory if you want to avoid conflicts with the Makefiles
|
||||
distributed with LAMMPS.
|
||||
|
||||
-----------------------------------
|
||||
|
||||
This directory has two generic Makefiles which should work as-is on
|
||||
many platforms.
|
||||
|
||||
Makefile.mpi assumes MPI is installed on your machine
|
||||
Makefile.serial build without MPI for serial execution (single core)
|
||||
|
||||
Makefile.mpi builds with the mpicxx wrapper provided with all MPI
|
||||
installations. It uses a default compiler (the one MPI was built
|
||||
with) and should work with whatever version of MPI is installed
|
||||
(OpenMPI, MPICH, vendor, etc).
|
||||
|
||||
Makefile.serial builds without MPI, using the GNU g++ compiler. It
|
||||
uses the dummy MPI library in src/STUBS, which you can pre-build via
|
||||
"make stubs" in the src dir. See Makefile.serial_icc in the OPTIONS
|
||||
dir for the same thing using the Intel icc compiler instead of g++.
|
||||
|
||||
-----------------------------------
|
||||
|
||||
The OPTIONS directory has several Makefiles that extend either
|
||||
Makefile.mpi or Makefile.serial to enable use of different compilers,
|
||||
different MPIs, or accelerator package and command options that LAMMPS
|
||||
supports.
|
||||
|
||||
--------
|
||||
|
||||
Makefile.fftw FFTW support for long-range Coulombics (PPPM)
|
||||
Makefile.jpeg JPEG support for dump image
|
||||
Makefile.png PNG support for dump image
|
||||
|
||||
These Makefiles are the same as Makefile.mpi except they add settings
|
||||
for commonly used options (FFTW, JPG, PNG) to illustrate how they can
|
||||
be added to any Makefile.
|
||||
|
||||
--------
|
||||
|
||||
Makefile.kokkos_omp KOKKOS package with CUDA support via nvcc compiler
|
||||
Makefile.kokkos_cuda KOKKOS package with CUDA support via nvcc compiler
|
||||
Makefile.kokkos_phi KOKKOS package with CUDA support via nvcc compiler
|
||||
|
||||
These Makefiles are for building with the KOKKOS package for different
|
||||
architectures (multi-core with OpenMP threading, GPU, Xeon Phi). Some
|
||||
Makefile variables are set and appended to.
|
||||
|
||||
--------
|
||||
|
||||
Makefile.intel_cpu USER-INTEL package with CPU acceleration
|
||||
Makefile.intel_phi USER-INTEL package with Xeon Phi support
|
||||
|
||||
These Makefiles are for building with the USER-INTEL package with
|
||||
either CPU or Xeon Phi (offload) support. Some Makefile variables are
|
||||
set and appended to.
|
||||
|
||||
--------
|
||||
|
||||
Makefile.mpich_g++ compile with MPICH wrapper, set compiler to GNU g++
|
||||
Makefile.mpich_icc compile with MPICH wrapper, set compiler to Intel icc
|
||||
Makefile.ompi_g++ compile with OpenMPI wrapper, set compiler to GNU g++
|
||||
Makefile.ompi_icc compile with OpenMPI wrapper, set compiler to Intel icc
|
||||
|
||||
Makefile.serial_icc serial build with Intel icc compiler
|
||||
Makefile.pgi MPI guild with the PGI compiler
|
||||
|
||||
These Makefiles adapt Makefile.mpi and Makefile.serial to use specific
|
||||
compilers.
|
||||
|
||||
--------
|
||||
|
||||
Makefile.mpich_native_g++ compile with GNU g++, link to MPICH
|
||||
Makefile.mpich_native_icc compile with Intel icc, link to MPICH
|
||||
Makefile.ompi_native_g++ compile with GNU g++, link to OpenMPI
|
||||
Makefile.ompi_native_icc compile with Intel icc, link to OpenMPI
|
||||
|
||||
These Makefiles show how to build with MPI support, but not using the
|
||||
MPI wrapper "mpicxx" for compiling. Instead, g++ or icc is used
|
||||
directly to compile and the MPI library is linked to. This requires
|
||||
extra settings for the MPI variables to specify the MPI include and
|
||||
library files.
|
||||
|
||||
------------------------------------
|
||||
|
||||
The MACHINE sub-directory has many Makefiles, each of which has been
|
||||
setup for a specific kind of machine or a specific supercomputer.
|
||||
|
||||
Examples include:
|
||||
|
||||
Makefile.mac Apple Macintosh
|
||||
Makefile.xe6 Cray XE6
|
||||
Makefile.bgq IBM BG/Q
|
||||
Makefile.stampede U Texas "stampede" machine
|
||||
Loading…
Reference in New Issue