mirror of https://github.com/lammps/lammps.git
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3239 f3b2605a-c512-4ea7-a41b-209d697bcdaa
This commit is contained in:
sjplimp
parent
82338889f0
commit
b4d72e83b2
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@ -1,71 +0,0 @@
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# cheetah = ORNL IBM machine, mpCC, native MPI, FFTW
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SHELL = /bin/sh
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.SUFFIXES: .cpp .u
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.IGNORE:
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# System-specific settings
|
||||
# edit as needed for your machine
|
||||
|
||||
# additional system libs needed by LAMMPS libs
|
||||
# NOTE: these settings are ignored if the LAMMPS package (e.g. gpu, meam)
|
||||
# which needs these libs is not included in the LAMMPS build
|
||||
|
||||
gpu_SYSLIB = -lcudart
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meam_SYSLIB = -lifcore -lsvml -lompstub -limf
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reax_SYSLIB = -lifcore -lsvml -lompstub -limf
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||||
user-atc_SYSLIB = -lblas -llapack
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||||
|
||||
gpu_SYSLIBPATH = -L/usr/local/cuda/lib64
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meam_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
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reax_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
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user-atc_SYSLIBPATH =
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||||
|
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include Makefile.package
|
||||
|
||||
# compiler/linker settings
|
||||
# NOTE: specify how to compile/link with MPI
|
||||
# either an MPI installed on your machine, or the src/STUBS dummy lib
|
||||
# NOTE: specify an FFT option, e.g. -DFFT_NONE, -DFFT_FFTW, etc
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||||
|
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CC = mpCC_r
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CCFLAGS = $(PKGINC) -O4 -qnoipa -I/usr/apps/include -DFFT_FFTW
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DEPFLAGS = -M
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LINK = mpCC_r
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LINKFLAGS = $(PKGPATH) $(PKGPATHSYS)
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USRLIB = $(PKGLIB) -lfftw
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SYSLIB = $(PKGLIBSYS)
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SIZE = size
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||||
|
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# Link rule
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||||
|
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$(EXE): $(OBJ)
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||||
$(LINK) $(LINKFLAGS) $(OBJ) $(USRLIB) $(SYSLIB) -o $(EXE)
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||||
$(SIZE) $(EXE)
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||||
|
||||
# --------- old section -------------
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|
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# Compilation rules
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||||
|
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#.cpp.o:
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# $(CC) $(CCFLAGS) -c $<
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|
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# Individual dependencies
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||||
|
||||
#$(OBJ): $(INC)
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||||
|
||||
# --------- new section -------------
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||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp
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||||
$(CC) $(CCFLAGS) -c $<
|
||||
|
||||
%.u:%.cpp
|
||||
$(CC) $(CCFLAGS) $(DEPFLAGS) -c $<
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||||
|
||||
# Individual dependencies
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||||
|
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DEPENDS = $(OBJ:.o=.u)
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include $(DEPENDS)
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|
|
@ -1,53 +0,0 @@
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# crockett = RedHat Linux box, mpiCC, LAM MPI, no FFTs
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|
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SHELL = /bin/sh
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#.IGNORE:
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||||
|
||||
# ---------------------------------------------------------------------
|
||||
# System-specific settings
|
||||
# edit as needed for your machine
|
||||
|
||||
# additional system libs needed by LAMMPS libs
|
||||
# NOTE: these settings are ignored if the LAMMPS package (e.g. gpu, meam)
|
||||
# which needs these libs is not included in the LAMMPS build
|
||||
|
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gpu_SYSLIB = -lcudart
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meam_SYSLIB = -lifcore -lsvml -lompstub -limf
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reax_SYSLIB = -lifcore -lsvml -lompstub -limf
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user-atc_SYSLIB = -lblas -llapack
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|
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gpu_SYSLIBPATH = -L/usr/local/cuda/lib64
|
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meam_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
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reax_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
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user-atc_SYSLIBPATH =
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|
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include Makefile.package
|
||||
|
||||
# compiler/linker settings
|
||||
# NOTE: specify how to compile/link with MPI
|
||||
# either an MPI installed on your machine, or the src/STUBS dummy lib
|
||||
# NOTE: specify an FFT option, e.g. -DFFT_NONE, -DFFT_FFTW, etc
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|
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CC = mpiCC
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CCFLAGS = $(PKGINC) -g -O -DFFT_NONE -DLAMMPS_GZIP
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DEPFLAGS = -M
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LINK = mpiCC
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LINKFLAGS = $(PKGPATH) $(PKGPATHSYS)
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USRLIB =$(PKGLIB)
|
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SYSLIB = $(PKGLIBSYS)
|
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SIZE = size
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|
||||
# Link rule
|
||||
|
||||
$(EXE): $(OBJ)
|
||||
$(LINK) $(LINKFLAGS) $(OBJ) $(USRLIB) $(SYSLIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
.cpp.o:
|
||||
$(CC) $(CCFLAGS) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
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$(OBJ): $(INC)
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||||
|
|
@ -1,67 +0,0 @@
|
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# debian = Debian, g++, MPICH, FFTW
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|
||||
SHELL = /bin/sh
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#.IGNORE:
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||||
|
||||
# ---------------------------------------------------------------------
|
||||
# System-specific settings
|
||||
# edit as needed for your machine
|
||||
|
||||
# additional system libs needed by LAMMPS libs
|
||||
# NOTE: these settings are ignored if the LAMMPS package (e.g. gpu, meam)
|
||||
# which needs these libs is not included in the LAMMPS build
|
||||
|
||||
gpu_SYSLIB = -lcudart
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meam_SYSLIB = -lifcore -lsvml -lompstub -limf
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reax_SYSLIB = -lifcore -lsvml -lompstub -limf
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user-atc_SYSLIB = -lblas -llapack
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||||
|
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gpu_SYSLIBPATH = -L/usr/local/cuda/lib64
|
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meam_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
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reax_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
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user-atc_SYSLIBPATH =
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|
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include Makefile.package
|
||||
|
||||
# compiler/linker settings
|
||||
# NOTE: specify how to compile/link with MPI
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||||
# either an MPI installed on your machine, or the src/STUBS dummy lib
|
||||
# NOTE: specify an FFT option, e.g. -DFFT_NONE, -DFFT_FFTW, etc
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|
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CC = g++
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CCFLAGS = $(PKGINC) -g -O -I/usr/lib/mpich/include/ -DFFT_FFTW -DLAMMPS_GZIP
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DEPFLAGS = -M
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LINK = g++
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LINKFLAGS = -g -O -L/usr/lib/mpich/lib $(PKGPATH) $(PKGPATHSYS)
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USRLIB = $(PKGLIB) -lfftw -lmpich
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SYSLIB = $(PKGLIBSYS)
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||||
ARCHIVE = ar
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||||
ARFLAGS = -rc
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||||
SIZE = size
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||||
|
||||
# ---------------------------------------------------------------------
|
||||
# no need to edit below here
|
||||
|
||||
# Link target
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||||
|
||||
$(EXE): $(OBJ)
|
||||
$(LINK) $(LINKFLAGS) $(OBJ) $(USRLIB) $(SYSLIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
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||||
|
||||
# Library target
|
||||
|
||||
lib: $(OBJ)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp
|
||||
$(CC) $(CCFLAGS) -c $<
|
||||
|
||||
%.d:%.cpp
|
||||
$(CC) $(CCFLAGS) $(DEPFLAGS) $< > $@
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
DEPENDS = $(OBJ:.o=.d)
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include $(DEPENDS)
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||||
|
|
@ -1,62 +0,0 @@
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# diesel = SGI Origin 350, 64-bit, SGI MIPSpro CC, SGI MPT, SGI SCSL MP FFTs
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|
||||
SHELL = /bin/sh
|
||||
#.IGNORE:
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# System-specific settings
|
||||
# edit as needed for your machine
|
||||
|
||||
# additional system libs needed by LAMMPS libs
|
||||
# NOTE: these settings are ignored if the LAMMPS package (e.g. gpu, meam)
|
||||
# which needs these libs is not included in the LAMMPS build
|
||||
|
||||
gpu_SYSLIB = -lcudart
|
||||
meam_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
reax_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
user-atc_SYSLIB = -lblas -llapack
|
||||
|
||||
gpu_SYSLIBPATH = -L/usr/local/cuda/lib64
|
||||
meam_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
reax_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
user-atc_SYSLIBPATH =
|
||||
|
||||
include Makefile.package
|
||||
|
||||
# compiler/linker settings
|
||||
# NOTE: specify how to compile/link with MPI
|
||||
# either an MPI installed on your machine, or the src/STUBS dummy lib
|
||||
# NOTE: specify an FFT option, e.g. -DFFT_NONE, -DFFT_FFTW, etc
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||||
|
||||
CC = CC
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||||
CCFLAGS = $(PKGINC) -64 -O -mp -DFFT_SCSL
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DEPFLAGS = -M
|
||||
LINK = CC
|
||||
LINKFLAGS = $(PKGPATH) $(PKGPATHSYS)
|
||||
USRLIB = $(PKGLIB)
|
||||
SYSLIB = $(PKGLIBSYS)
|
||||
SIZE = size
|
||||
|
||||
# Link rule
|
||||
|
||||
$(EXE): $(OBJ)
|
||||
$(LINK) $(LINKFLAGS) $(OBJ) $(USRLIB) $(SYSLIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library target
|
||||
|
||||
lib: $(OBJ)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp
|
||||
$(CC) $(CCFLAGS) -c $<
|
||||
|
||||
%.d:%.cpp
|
||||
$(CC) $(CCFLAGS) $(DEPFLAGS) $< > $@
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
DEPENDS = $(OBJ:.o=.d)
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||||
include $(DEPENDS)
|
||||
|
|
@ -1,56 +0,0 @@
|
|||
# freebsd = FreeBSD box, 7.0-RELEASE, LAM/MPI, FFTW
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# System-specific settings
|
||||
# edit as needed for your machine
|
||||
|
||||
# additional system libs needed by LAMMPS libs
|
||||
# NOTE: these settings are ignored if the LAMMPS package (e.g. gpu, meam)
|
||||
# which needs these libs is not included in the LAMMPS build
|
||||
|
||||
gpu_SYSLIB = -lcudart
|
||||
meam_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
reax_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
user-atc_SYSLIB = -lblas -llapack
|
||||
|
||||
gpu_SYSLIBPATH = -L/usr/local/cuda/lib64
|
||||
meam_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
reax_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
user-atc_SYSLIBPATH =
|
||||
|
||||
include Makefile.package
|
||||
|
||||
# compiler/linker settings
|
||||
# NOTE: specify how to compile/link with MPI
|
||||
# either an MPI installed on your machine, or the src/STUBS dummy lib
|
||||
# NOTE: specify an FFT option, e.g. -DFFT_NONE, -DFFT_FFTW, etc
|
||||
|
||||
CC = mpic++
|
||||
CCFLAGS = $(PKGINC) -O3 -DFFT_FFTW
|
||||
DEPFLAGS = -M
|
||||
LINK = mpic++
|
||||
LINKFLAGS = $(PKGPATH) $(PKGPATHSYS)
|
||||
USRLIB = $(PKGLIB) -lfftw -lmpi
|
||||
SYSLIB = $(PKGLIBSYS)
|
||||
SIZE = size
|
||||
|
||||
# Link rule
|
||||
|
||||
$(EXE): $(OBJ)
|
||||
$(LINK) $(LINKFLAGS) $(OBJ) $(USRLIB) $(SYSLIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp
|
||||
$(CC) $(CCFLAGS) -c $<
|
||||
|
||||
%.d:%.cpp
|
||||
$(CC) $(CCFLAGS) $(DEPFLAGS) $< > $@
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
DEPENDS = $(OBJ:.o=.d)
|
||||
include $(DEPENDS)
|
||||
|
|
@ -1,110 +0,0 @@
|
|||
# intel = Fedora Core 6, intel icc 9.1, FFTW2, no MPI
|
||||
|
||||
SHELL = /bin/sh
|
||||
#.IGNORE:
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# System-specific settings
|
||||
# edit as needed for your machine
|
||||
|
||||
# additional system libs needed by LAMMPS libs
|
||||
# NOTE: these settings are ignored if the LAMMPS package (e.g. gpu, meam)
|
||||
# which needs these libs is not included in the LAMMPS build
|
||||
|
||||
gpu_SYSLIB = -lcudart
|
||||
meam_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
reax_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
user-atc_SYSLIB = -lblas -llapack
|
||||
|
||||
gpu_SYSLIBPATH = -L/usr/local/cuda/lib64
|
||||
meam_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
reax_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
user-atc_SYSLIBPATH =
|
||||
|
||||
include Makefile.package
|
||||
|
||||
# compiler/linker settings
|
||||
# NOTE: specify how to compile/link with MPI
|
||||
# either an MPI installed on your machine, or the src/STUBS dummy lib
|
||||
# NOTE: specify an FFT option, e.g. -DFFT_NONE, -DFFT_FFTW, etc
|
||||
|
||||
CC = icpc
|
||||
CCFLAGS = $(PKGINC) -O2 -unroll -DFFT_FFTW -DLAMMPS_GZIP \
|
||||
-fstrict-aliasing -I../STUBS
|
||||
NOALIAS = -fno-strict-aliasing
|
||||
DEPFLAGS = -M
|
||||
LINK = icpc
|
||||
LINKFLAGS = $(PKGPATH) $(PKGPATHSYS)
|
||||
USRLIB = $(PKGLIB) -L../STUBS -lmpi -lfftw
|
||||
SYSLIB = $(PKGLIBSYS)
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rcsv
|
||||
SIZE = size
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# no need to edit below here
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ)
|
||||
$(LINK) $(LINKFLAGS) $(OBJ) $(USRLIB) $(SYSLIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library target
|
||||
|
||||
lib: $(OBJ)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp
|
||||
$(CC) $(CCFLAGS) -c $<
|
||||
|
||||
%.d:%.cpp
|
||||
$(CC) $(CCFLAGS) $(DEPFLAGS) $< > $@
|
||||
|
||||
# explicit overrides for files that violate ansi aliasing rules
|
||||
|
||||
pair.o : pair.cpp
|
||||
$(CC) $(CCFLAGS) $(NOALIAS) -c $<
|
||||
|
||||
pair_table.o : pair_table.cpp
|
||||
$(CC) $(CCFLAGS) $(NOALIAS) -c $<
|
||||
|
||||
pair_eam_alloy_opt.o : pair_eam_alloy_opt.cpp
|
||||
$(CC) $(CCFLAGS) $(NOALIAS) -c $<
|
||||
|
||||
pair_eam_fs_opt.o : pair_eam_fs_opt.cpp
|
||||
$(CC) $(CCFLAGS) $(NOALIAS) -c $<
|
||||
|
||||
pair_eam_opt.o : pair_eam_opt.cpp
|
||||
$(CC) $(CCFLAGS) $(NOALIAS) -c $<
|
||||
|
||||
pair_lj_charmm_coul_long_opt.o : pair_lj_charmm_coul_long_opt.cpp
|
||||
$(CC) $(CCFLAGS) $(NOALIAS) -c $<
|
||||
|
||||
pair_lj_cut_opt.o : pair_lj_cut_opt.cpp
|
||||
$(CC) $(CCFLAGS) $(NOALIAS) -c $<
|
||||
|
||||
pair_morse_opt.o : pair_morse_opt.cpp
|
||||
$(CC) $(CCFLAGS) $(NOALIAS) -c $<
|
||||
|
||||
pair_lj_cut_coul_long.o : pair_lj_cut_coul_long.cpp
|
||||
$(CC) $(CCFLAGS) $(NOALIAS) -c $<
|
||||
|
||||
pair_cg_cut_coul_cut.o : pair_cg_cut_coul_cut.cpp
|
||||
$(CC) $(CCFLAGS) $(NOALIAS) -c $<
|
||||
|
||||
pair_cg_cut_coul_long.o : pair_cg_cut_coul_long.cpp
|
||||
$(CC) $(CCFLAGS) $(NOALIAS) -c $<
|
||||
|
||||
pair_lj_charmm_coul_long.o : pair_lj_charmm_coul_long.cpp
|
||||
$(CC) $(CCFLAGS) $(NOALIAS) -c $<
|
||||
|
||||
pair_lj_cut_coul_long_tip4p.o : pair_lj_cut_coul_long_tip4p.cpp
|
||||
$(CC) $(CCFLAGS) $(NOALIAS) -c $<
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
DEPENDS = $(OBJ:.o=.d)
|
||||
include $(DEPENDS)
|
||||
|
|
@ -1,73 +0,0 @@
|
|||
# intel_mkl = Intel Cluster Tools with MKL library for FFTs and MPI
|
||||
|
||||
# Intel C++, Intel MPI, Intel MKL FFTs
|
||||
# Intel recommends Intel Cluster Tools Compiler Edition
|
||||
# to build libfftw2xc_intel.a:
|
||||
# > cd /opt/intel/mkl/10.0.011/interfaces/fftw2xc
|
||||
# > become root via su
|
||||
# > gmake libem64t
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# System-specific settings
|
||||
# edit as needed for your machine
|
||||
|
||||
# additional system libs needed by LAMMPS libs
|
||||
# NOTE: these settings are ignored if the LAMMPS package (e.g. gpu, meam)
|
||||
# which needs these libs is not included in the LAMMPS build
|
||||
|
||||
gpu_SYSLIB = -lcudart
|
||||
meam_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
reax_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
user-atc_SYSLIB = -lblas -llapack
|
||||
|
||||
gpu_SYSLIBPATH = -L/usr/local/cuda/lib64
|
||||
meam_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
reax_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
user-atc_SYSLIBPATH =
|
||||
|
||||
include Makefile.package
|
||||
|
||||
# compiler/linker settings
|
||||
# NOTE: specify how to compile/link with MPI
|
||||
# either an MPI installed on your machine, or the src/STUBS dummy lib
|
||||
# NOTE: specify an FFT option, e.g. -DFFT_NONE, -DFFT_FFTW, etc
|
||||
|
||||
CC = mpiicc
|
||||
CCFLAGS = $(PKGINC) -O3 -fno-alias -ip -unroll0 -g -DMPICH_IGNORE_CXX_SEEK -DLAMMPS_GZIP -DFFT_FFTW -I/opt/intel/mkl/10.0.011/include/fftw
|
||||
DEPFLAGS = -M
|
||||
LINK = mpiicc
|
||||
LINKFLAGS = $(PKGPATH) $(PKGPATHSYS)
|
||||
USRLIB = $(PKGLIB) /opt/intel/mkl/10.0.011/lib/em64t/libfftw2xc_intel.a
|
||||
SYSLIB = $(PKGLIBSYS)
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SIZE = size
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# no need to edit below here
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ)
|
||||
$(LINK) $(LINKFLAGS) $(OBJ) $(USRLIB) $(SYSLIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library target
|
||||
|
||||
lib: $(OBJ)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp
|
||||
$(CC) $(CCFLAGS) -c $<
|
||||
|
||||
%.d:%.cpp
|
||||
$(CC) $(CCFLAGS) $(DEPFLAGS) $< > $@
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
DEPENDS = $(OBJ:.o=.d)
|
||||
include $(DEPENDS)
|
||||
|
|
@ -1,66 +0,0 @@
|
|||
# opensuse = openSUSE linux, g++, MPICH, FFTW
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# System-specific settings
|
||||
# edit as needed for your machine
|
||||
|
||||
# additional system libs needed by LAMMPS libs
|
||||
# NOTE: these settings are ignored if the LAMMPS package (e.g. gpu, meam)
|
||||
# which needs these libs is not included in the LAMMPS build
|
||||
|
||||
gpu_SYSLIB = -lcudart
|
||||
meam_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
reax_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
user-atc_SYSLIB = -lblas -llapack
|
||||
|
||||
gpu_SYSLIBPATH = -L/usr/local/cuda/lib64
|
||||
meam_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
reax_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
user-atc_SYSLIBPATH =
|
||||
|
||||
include Makefile.package
|
||||
|
||||
# compiler/linker settings
|
||||
# NOTE: specify how to compile/link with MPI
|
||||
# either an MPI installed on your machine, or the src/STUBS dummy lib
|
||||
# NOTE: specify an FFT option, e.g. -DFFT_NONE, -DFFT_FFTW, etc
|
||||
|
||||
CC = g++
|
||||
CCFLAGS = $(PKGINC) -O3 -I /opt/mpich/include/ -DFFT_FFTW -DLAMMPS_GZIP
|
||||
DEPFLAGS = -M
|
||||
LINK = g++
|
||||
LINKFLAGS = $(PKGPATH) $(PKGPATHSYS)
|
||||
USRLIB = $(PKGLIB) -ldfftw -lmpich
|
||||
SYSLIB =$(PKGLIBSYS)
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SIZE = size
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# no need to edit below here
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ)
|
||||
$(LINK) $(LINKFLAGS) $(OBJ) $(USRLIB) $(SYSLIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library target
|
||||
|
||||
lib: $(OBJ)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp
|
||||
$(CC) $(CCFLAGS) -c $<
|
||||
|
||||
%.d:%.cpp
|
||||
$(CC) $(CCFLAGS) $(DEPFLAGS) $< > $@
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
DEPENDS = $(OBJ:.o=.d)
|
||||
include $(DEPENDS)
|
||||
|
|
@ -1,70 +0,0 @@
|
|||
# pg = Portland Group compiler, MPICH, FFTW
|
||||
|
||||
SHELL = /bin/sh
|
||||
#.IGNORE:
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# System-specific settings
|
||||
# edit as needed for your machine
|
||||
|
||||
# additional system libs needed by LAMMPS libs
|
||||
# NOTE: these settings are ignored if the LAMMPS package (e.g. gpu, meam)
|
||||
# which needs these libs is not included in the LAMMPS build
|
||||
|
||||
gpu_SYSLIB = -lcudart
|
||||
meam_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
reax_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
user-atc_SYSLIB = -lblas -llapack
|
||||
|
||||
gpu_SYSLIBPATH = -L/usr/local/cuda/lib64
|
||||
meam_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
reax_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
user-atc_SYSLIBPATH =
|
||||
|
||||
include Makefile.package
|
||||
|
||||
# compiler/linker settings
|
||||
# NOTE: specify how to compile/link with MPI
|
||||
# either an MPI installed on your machine, or the src/STUBS dummy lib
|
||||
# NOTE: specify an FFT option, e.g. -DFFT_NONE, -DFFT_FFTW, etc
|
||||
|
||||
CC = pgCC -fast
|
||||
CCFLAGS = $(PKGINC) -I/usr/local/mpich-1.2.6/pg/include \
|
||||
-I/usr/local/include \
|
||||
-DFFT_FFTW -DLAMMPS_GZIP
|
||||
DEPFLAGS = -M
|
||||
LINK = pgCC
|
||||
LINKFLAGS = $(PKGPATH) $(PKGPATHSYS)
|
||||
-L/usr/local/lib
|
||||
USRLIB = $(PKGLIB) -lfftw -lmpich
|
||||
SYSLIB = $(PKGLIBSYS)
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SIZE = size
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# no need to edit below here
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ)
|
||||
$(LINK) $(LINKFLAGS) $(OBJ) $(USRLIB) $(SYSLIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library target
|
||||
|
||||
lib: $(OBJ)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp
|
||||
$(CC) $(CCFLAGS) -c $<
|
||||
|
||||
%.d:%.cpp
|
||||
$(CC) $(CCFLAGS) $(DEPFLAGS) $< > $@
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
DEPENDS = $(OBJ:.o=.d)
|
||||
include $(DEPENDS)
|
||||
|
|
@ -1,66 +0,0 @@
|
|||
# serial_icc = RedHat Linux box, icc, no MPI, no FFTs
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# System-specific settings
|
||||
# edit as needed for your machine
|
||||
|
||||
# additional system libs needed by LAMMPS libs
|
||||
# NOTE: these settings are ignored if the LAMMPS package (e.g. gpu, meam)
|
||||
# which needs these libs is not included in the LAMMPS build
|
||||
|
||||
gpu_SYSLIB = -lcudart
|
||||
meam_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
reax_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
user-atc_SYSLIB = -lblas -llapack
|
||||
|
||||
gpu_SYSLIBPATH = -L/usr/local/cuda/lib64
|
||||
meam_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
reax_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
user-atc_SYSLIBPATH =
|
||||
|
||||
include Makefile.package
|
||||
|
||||
# compiler/linker settings
|
||||
# NOTE: specify how to compile/link with MPI
|
||||
# either an MPI installed on your machine, or the src/STUBS dummy lib
|
||||
# NOTE: specify an FFT option, e.g. -DFFT_NONE, -DFFT_FFTW, etc
|
||||
|
||||
CC = icc
|
||||
CCFLAGS = $(PKGINC) -O -I../STUBS -DFFT_NONE
|
||||
DEPFLAGS = -M
|
||||
LINK = icc
|
||||
LINKFLAGS = $(PKGPATH) $(PKGPATHSYS)
|
||||
USRLIB = $(PKGLIB) -lmpi
|
||||
SYSLIB = $(PKGLIBSYS)
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SIZE = size
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# no need to edit below here
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ)
|
||||
$(LINK) $(LINKFLAGS) $(OBJ) $(USRLIB) $(SYSLIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library target
|
||||
|
||||
lib: $(OBJ)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp
|
||||
$(CC) $(CCFLAGS) -c $<
|
||||
|
||||
%.d:%.cpp
|
||||
$(CC) $(CCFLAGS) $(DEPFLAGS) $< > $@
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
DEPENDS = $(OBJ:.o=.d)
|
||||
include $(DEPENDS)
|
||||
|
|
@ -1,64 +0,0 @@
|
|||
# squall = Red Squall (compile on srnsquall), pgiCC, MPI, FFTW
|
||||
#
|
||||
# To use this, first do:
|
||||
#
|
||||
# module unload compilers/gnu
|
||||
# module load compilers/pgi-6.0
|
||||
# module unload mpich/mpich-gnu
|
||||
# module load mpich/mpich-pgi-6.0
|
||||
#
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# System-specific settings
|
||||
# edit as needed for your machine
|
||||
|
||||
# additional system libs needed by LAMMPS libs
|
||||
# NOTE: these settings are ignored if the LAMMPS package (e.g. gpu, meam)
|
||||
# which needs these libs is not included in the LAMMPS build
|
||||
|
||||
gpu_SYSLIB = -lcudart
|
||||
meam_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
reax_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
user-atc_SYSLIB = -lblas -llapack
|
||||
|
||||
gpu_SYSLIBPATH = -L/usr/local/cuda/lib64
|
||||
meam_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
reax_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
user-atc_SYSLIBPATH =
|
||||
|
||||
include Makefile.package
|
||||
|
||||
# compiler/linker settings
|
||||
# NOTE: specify how to compile/link with MPI
|
||||
# either an MPI installed on your machine, or the src/STUBS dummy lib
|
||||
# NOTE: specify an FFT option, e.g. -DFFT_NONE, -DFFT_FFTW, etc
|
||||
|
||||
CC = mpiCC
|
||||
CCFLAGS = $(PKGINC) -DFFT_FFTW -I/home/athomps/tools/fftw-2.1.5/fftw
|
||||
DEPFLAGS = -O2 -M
|
||||
LINK = mpiCC
|
||||
LINKFLAGS = $(PKGPATH) $(PKGPATHSYS)
|
||||
USRLIB = $(PKGLIB) -lfftw -lmpi
|
||||
SYSLIB = $(PKGLIBSYS)
|
||||
SIZE = size
|
||||
|
||||
# Link rule
|
||||
|
||||
$(EXE): $(OBJ)
|
||||
$(LINK) $(LINKFLAGS) $(OBJ) $(USRLIB) $(SYSLIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp
|
||||
$(CC) $(CCFLAGS) -c $<
|
||||
|
||||
%.d:%.cpp
|
||||
$(CC) $(CCFLAGS) $(DEPFLAGS) $< > $@
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
DEPENDS = $(OBJ:.o=.d)
|
||||
include $(DEPENDS)
|
||||
|
|
@ -1,59 +0,0 @@
|
|||
# valor = HP cluster with dual Xeons, mpiCC, native MPI, FFTW
|
||||
|
||||
SHELL = /bin/sh
|
||||
.IGNORE:
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# System-specific settings
|
||||
# edit as needed for your machine
|
||||
|
||||
# additional system libs needed by LAMMPS libs
|
||||
# NOTE: these settings are ignored if the LAMMPS package (e.g. gpu, meam)
|
||||
# which needs these libs is not included in the LAMMPS build
|
||||
|
||||
gpu_SYSLIB = -lcudart
|
||||
meam_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
reax_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
user-atc_SYSLIB = -lblas -llapack
|
||||
|
||||
gpu_SYSLIBPATH = -L/usr/local/cuda/lib64
|
||||
meam_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
reax_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
user-atc_SYSLIBPATH =
|
||||
|
||||
include Makefile.package
|
||||
|
||||
# compiler/linker settings
|
||||
# NOTE: specify how to compile/link with MPI
|
||||
# either an MPI installed on your machine, or the src/STUBS dummy lib
|
||||
# NOTE: specify an FFT option, e.g. -DFFT_NONE, -DFFT_FFTW, etc
|
||||
|
||||
FFTW = /apps/libraries/fftw-2.1.5
|
||||
|
||||
CC = mpiCC
|
||||
CCFLAGS = $(PKGINC) -O -DFFT_FFTW -I${FFTW}/include
|
||||
DEPFLAGS = -M
|
||||
LINK = mpiCC
|
||||
LINKFLAGS = $(PKGPATH) $(PKGPATHSYS)
|
||||
USRLIB = $(PKGLIB) -lfftw -lstdc++
|
||||
SYSLIB = $(PKGLIBSYS)
|
||||
SIZE = size
|
||||
|
||||
# Link rule
|
||||
|
||||
$(EXE): $(OBJ)
|
||||
$(LINK) $(LINKFLAGS) $(OBJ) $(USRLIB) $(SYSLIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp
|
||||
$(CC) $(CCFLAGS) -c $<
|
||||
|
||||
%.d:%.cpp
|
||||
$(CC) $(CCFLAGS) $(DEPFLAGS) $< > $@
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
DEPENDS = $(OBJ:.o=.d)
|
||||
include $(DEPENDS)
|
||||
|
|
@ -1,65 +0,0 @@
|
|||
# ydl = Yellow Dog Linux box, xlc -q64, MPICH, FFTW
|
||||
|
||||
SHELL = /bin/sh
|
||||
#.IGNORE:
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# System-specific settings
|
||||
# edit as needed for your machine
|
||||
|
||||
# additional system libs needed by LAMMPS libs
|
||||
# NOTE: these settings are ignored if the LAMMPS package (e.g. gpu, meam)
|
||||
# which needs these libs is not included in the LAMMPS build
|
||||
|
||||
gpu_SYSLIB = -lcudart
|
||||
meam_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
reax_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
user-atc_SYSLIB = -lblas -llapack
|
||||
|
||||
gpu_SYSLIBPATH = -L/usr/local/cuda/lib64
|
||||
meam_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
reax_SYSLIBPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
user-atc_SYSLIBPATH =
|
||||
|
||||
include Makefile.package
|
||||
|
||||
# compiler/linker settings
|
||||
# NOTE: specify how to compile/link with MPI
|
||||
# either an MPI installed on your machine, or the src/STUBS dummy lib
|
||||
# NOTE: specify an FFT option, e.g. -DFFT_NONE, -DFFT_FFTW, etc
|
||||
|
||||
CC = xlc -q64
|
||||
CCFLAGS = $(PKGINC) -g -O -I/opt/mpich/include \
|
||||
-I/usr/local/include -L/opt/mpich/lib64 \
|
||||
-DFFT_FFTW -DLAMMPS_LAMMPS_GZIP
|
||||
DEPFLAGS = -M
|
||||
LINK = xlc -q64
|
||||
LINKFLAGS = $(PKGPATH) $(PKGPATHSYS)
|
||||
-L/usr/local/lib -lstdc++ -lc
|
||||
USRLIB = $(PKGLIB) -lfftw -lmpich
|
||||
SYSLIB =$(PKGLIBSYS)
|
||||
SIZE = size
|
||||
|
||||
# Link rule
|
||||
|
||||
$(EXE): $(OBJ)
|
||||
$(LINK) $(LINKFLAGS) $(OBJ) $(USRLIB) $(SYSLIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library target
|
||||
|
||||
lib: $(OBJ)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp
|
||||
$(CC) $(CCFLAGS) -c $<
|
||||
|
||||
%.d:%.cpp
|
||||
$(CC) $(CCFLAGS) $(DEPFLAGS) $< > $@
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
DEPENDS = $(OBJ:.o=.d)
|
||||
include $(DEPENDS)
|
||||
Loading…
Reference in New Issue