forked from lijiext/lammps
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4161 f3b2605a-c512-4ea7-a41b-209d697bcdaa
This commit is contained in:
sjplimp
parent
7aba69e4ab
commit
f2ab1cb3dd
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@ -0,0 +1,93 @@
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# g++3 = RedHat Linux box, g++ (v3), Intel ifort, MPICH2, FFTW
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SHELL = /bin/sh
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# ---------------------------------------------------------------------
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# compiler/linker settings
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# specify flags and libraries needed for your compiler
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CC = g++
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CCFLAGS = -g -O
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DEPFLAGS = -M
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LINK = g++
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LINKFLAGS = -g -O
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LIB =
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ARCHIVE = ar
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ARFLAGS = -rc
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SIZE = size
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# ---------------------------------------------------------------------
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# LAMMPS-specific settings
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# specify settings for LAMMPS features you will use
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# LAMMPS ifdef options, see doc/Section_start.html
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LMP_INC = -DLAMMPS_GZIP
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# MPI library, can be src/STUBS dummy lib
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# INC = path for mpi.h, MPI compiler settings
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# PATH = path for MPI library
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# LIB = name of MPI library
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MPI_INC = -DMPICH_IGNORE_CXX_SEEK
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MPI_PATH =
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MPI_LIB = -lmpich -lpthread
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# FFT library, can be -DFFT_NONE if not using PPPM from KSPACE package
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# INC = -DFFT_FFTW, -DFFT_INTEL, -DFFT_NONE, etc, FFT compiler settings
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# PATH = path for FFT library
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# LIB = name of FFT library
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FFT_INC = -DFFT_FFTW
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FFT_PATH =
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FFT_LIB = -lfftw
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# additional system libraries needed by LAMMPS package libraries
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# these settings are IGNORED if the corresponding LAMMPS package
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# (e.g. gpu, meam) is NOT included in the LAMMPS build
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# SYSLIB = names of libraries
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# SYSPATH = paths of libraries
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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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gpu_SYSPATH = -L/usr/local/cuda/lib64
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meam_SYSPATH = -L/opt/intel/fce/10.0.023/lib
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reax_SYSPATH = -L/opt/intel/fce/10.0.023/lib
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user-atc_SYSPATH =
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# ---------------------------------------------------------------------
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# build rules and dependencies
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# no need to edit this section
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include Makefile.package
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EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC)
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EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(PKG_SYSPATH)
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EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(PKG_SYSLIB)
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# Link target
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$(EXE): $(OBJ)
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$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
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$(SIZE) $(EXE)
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# Library target
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lib: $(OBJ)
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$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
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# Compilation rules
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%.o:%.cpp
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$(CC) $(CCFLAGS) $(EXTRA_INC) -c $<
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%.d:%.cpp
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$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
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# Individual dependencies
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DEPENDS = $(OBJ:.o=.d)
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include $(DEPENDS)
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@ -0,0 +1,93 @@
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# lam = FreeBSD box, mpic++, Intel ifort, LAM/MPI, FFTW
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SHELL = /bin/sh
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# ---------------------------------------------------------------------
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# compiler/linker settings
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# specify flags and libraries needed for your compiler
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CC = mpic++
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CCFLAGS = -O3
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DEPFLAGS = -M
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LINK = mpic++
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LINKFLAGS = -O3
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LIB = -lstdc++
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ARCHIVE = ar
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ARFLAGS = -rc
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SIZE = size
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# ---------------------------------------------------------------------
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# LAMMPS-specific settings
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# specify settings for LAMMPS features you will use
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# LAMMPS ifdef options, see doc/Section_start.html
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LMP_INC = -DLAMMPS_GZIP
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# MPI library, can be src/STUBS dummy lib
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# INC = path for mpi.h, MPI compiler settings
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# PATH = path for MPI library
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# LIB = name of MPI library
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MPI_INC =
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MPI_PATH =
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MPI_LIB = -lmpi
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# FFT library, can be -DFFT_NONE if not using PPPM from KSPACE package
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# INC = -DFFT_FFTW, -DFFT_INTEL, -DFFT_NONE, etc, FFT compiler settings
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# PATH = path for FFT library
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# LIB = name of FFT library
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FFT_INC = -DFFT_FFTW
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FFT_PATH =
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FFT_LIB = -lfftw
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# additional system libraries needed by LAMMPS package libraries
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# these settings are IGNORED if the corresponding LAMMPS package
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# (e.g. gpu, meam) is NOT included in the LAMMPS build
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# SYSLIB = names of libraries
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# SYSPATH = paths of libraries
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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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gpu_SYSPATH = -L/usr/local/cuda/lib64
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meam_SYSPATH = -L/opt/intel/fce/10.0.023/lib
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reax_SYSPATH = -L/opt/intel/fce/10.0.023/lib
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user-atc_SYSPATH =
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# ---------------------------------------------------------------------
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# build rules and dependencies
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# no need to edit this section
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include Makefile.package
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EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC)
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EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(PKG_SYSPATH)
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EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(PKG_SYSLIB)
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# Link target
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$(EXE): $(OBJ)
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$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
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$(SIZE) $(EXE)
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# Library target
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lib: $(OBJ)
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$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
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# Compilation rules
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%.o:%.cpp
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$(CC) $(CCFLAGS) $(EXTRA_INC) -c $<
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%.d:%.cpp
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$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
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# Individual dependencies
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DEPENDS = $(OBJ:.o=.d)
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include $(DEPENDS)
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@ -0,0 +1,99 @@
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# mkl = Intel Cluster Tools, mpiicc, MKL MPI, MKL FFT
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# Intel recommends Intel Cluster Tools Compiler Edition
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# to build libfftw2xc_intel.a:
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# > cd /opt/intel/mkl/10.0.011/interfaces/fftw2xc
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# > become root via su
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# > gmake libem64t
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SHELL = /bin/sh
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# ---------------------------------------------------------------------
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# compiler/linker settings
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# specify flags and libraries needed for your compiler
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CC = mpiicc
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CCFLAGS = -O3 -fno-alias -ip -unroll0
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DEPFLAGS = -M
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LINK = mpiicc
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LINKFLAGS = -O -L/opt/intel/mkl/10.0.011/lib/em64t
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LIB = -lstdc++ -lpthread -lmkl_em64t -lguide
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ARCHIVE = ar
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ARFLAGS = -rc
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SIZE = size
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|
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# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings
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||||
# specify settings for LAMMPS features you will use
|
||||
|
||||
# LAMMPS ifdef options, see doc/Section_start.html
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
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|
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# MPI library, can be src/STUBS dummy lib
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||||
# INC = path for mpi.h, MPI compiler settings
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# PATH = path for MPI library
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# LIB = name of MPI library
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MPI_INC = -DMPICH_IGNORE_CXX_SEEK
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MPI_PATH =
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MPI_LIB = -mt_mpi
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# FFT library, can be -DFFT_NONE if not using PPPM from KSPACE package
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# INC = -DFFT_FFTW, -DFFT_INTEL, -DFFT_NONE, etc, FFT compiler settings
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# PATH = path for FFT library
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# LIB = name of FFT library
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FFT_INC = -DFFT_FFTW -I/opt/intel/mkl/10.0.011/include/fftw
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FFT_PATH =
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FFT_LIB = /opt/intel/mkl/10.0.011/lib/em64t/libfftw2xc_intel.a
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|
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# additional system libraries needed by LAMMPS package libraries
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||||
# these settings are IGNORED if the corresponding LAMMPS package
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||||
# (e.g. gpu, meam) is NOT included in the LAMMPS build
|
||||
# SYSLIB = names of libraries
|
||||
# SYSPATH = paths of libraries
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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_SYSPATH = -L/usr/local/cuda/lib64
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meam_SYSPATH = -L/opt/intel/fce/10.0.023/lib
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reax_SYSPATH = -L/opt/intel/fce/10.0.023/lib
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user-atc_SYSPATH =
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|
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# ---------------------------------------------------------------------
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||||
# build rules and dependencies
|
||||
# no need to edit this section
|
||||
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(PKG_SYSPATH)
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EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(PKG_SYSLIB)
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|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
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||||
|
||||
# Library target
|
||||
|
||||
lib: $(OBJ)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
# Individual dependencies
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||||
|
||||
DEPENDS = $(OBJ:.o=.d)
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include $(DEPENDS)
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@ -0,0 +1,93 @@
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# pgi = Portland Group compiler, pgCC, MPICH, FFTW
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SHELL = /bin/sh
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# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
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|
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CC = pgCC
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CCFLAGS = -fast
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DEPFLAGS = -M
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LINK = pgCC
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LINKFLAGS =
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LIB = -lstdc++
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||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
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||||
SIZE = size
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings
|
||||
# specify settings for LAMMPS features you will use
|
||||
|
||||
# LAMMPS ifdef options, see doc/Section_start.html
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library, can be src/STUBS dummy lib
|
||||
# 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
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||||
MPI_LIB = -lmpich
|
||||
|
||||
# FFT library, can be -DFFT_NONE if not using PPPM from KSPACE package
|
||||
# INC = -DFFT_FFTW, -DFFT_INTEL, -DFFT_NONE, etc, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_FFTW
|
||||
FFT_PATH =
|
||||
FFT_LIB = -lfftw
|
||||
|
||||
# additional system libraries needed by LAMMPS package libraries
|
||||
# these settings are IGNORED if the corresponding LAMMPS package
|
||||
# (e.g. gpu, meam) is NOT included in the LAMMPS build
|
||||
# SYSLIB = names of libraries
|
||||
# SYSPATH = paths of libraries
|
||||
|
||||
gpu_SYSLIB = -lcudart
|
||||
meam_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
reax_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
user-atc_SYSLIB = -lblas -llapack
|
||||
|
||||
gpu_SYSPATH = -L/usr/local/cuda/lib64
|
||||
meam_SYSPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
reax_SYSPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
user-atc_SYSPATH =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# no need to edit this section
|
||||
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(PKG_SYSLIB)
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library target
|
||||
|
||||
lib: $(OBJ)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
DEPENDS = $(OBJ:.o=.d)
|
||||
include $(DEPENDS)
|
||||
|
|
@ -0,0 +1,93 @@
|
|||
# sgi = SGI Origin 350 64-bit, SGI MIPSpro CC, SGI MPI, SGI SCSL MP FFTs
|
||||
|
||||
SHELL = /bin/sh
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# compiler/linker settings
|
||||
# specify flags and libraries needed for your compiler
|
||||
|
||||
CC = CC
|
||||
CCFLAGS = -64 -O -mp
|
||||
DEPFLAGS = -M
|
||||
LINK = CC
|
||||
LINKFLAGS = -O
|
||||
LIB = -lstdc++
|
||||
ARCHIVE = ar
|
||||
ARFLAGS = -rc
|
||||
SIZE = size
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# LAMMPS-specific settings
|
||||
# specify settings for LAMMPS features you will use
|
||||
|
||||
# LAMMPS ifdef options, see doc/Section_start.html
|
||||
|
||||
LMP_INC = -DLAMMPS_GZIP
|
||||
|
||||
# MPI library, can be src/STUBS dummy lib
|
||||
# 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, can be -DFFT_NONE if not using PPPM from KSPACE package
|
||||
# INC = -DFFT_FFTW, -DFFT_INTEL, -DFFT_NONE, etc, FFT compiler settings
|
||||
# PATH = path for FFT library
|
||||
# LIB = name of FFT library
|
||||
|
||||
FFT_INC = -DFFT_SCSL
|
||||
FFT_PATH =
|
||||
FFT_LIB =
|
||||
|
||||
# additional system libraries needed by LAMMPS package libraries
|
||||
# these settings are IGNORED if the corresponding LAMMPS package
|
||||
# (e.g. gpu, meam) is NOT included in the LAMMPS build
|
||||
# SYSLIB = names of libraries
|
||||
# SYSPATH = paths of libraries
|
||||
|
||||
gpu_SYSLIB = -lcudart
|
||||
meam_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
reax_SYSLIB = -lifcore -lsvml -lompstub -limf
|
||||
user-atc_SYSLIB = -lblas -llapack
|
||||
|
||||
gpu_SYSPATH = -L/usr/local/cuda/lib64
|
||||
meam_SYSPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
reax_SYSPATH = -L/opt/intel/fce/10.0.023/lib
|
||||
user-atc_SYSPATH =
|
||||
|
||||
# ---------------------------------------------------------------------
|
||||
# build rules and dependencies
|
||||
# no need to edit this section
|
||||
|
||||
include Makefile.package
|
||||
|
||||
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC)
|
||||
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(PKG_SYSPATH)
|
||||
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(PKG_SYSLIB)
|
||||
|
||||
# Link target
|
||||
|
||||
$(EXE): $(OBJ)
|
||||
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||
$(SIZE) $(EXE)
|
||||
|
||||
# Library target
|
||||
|
||||
lib: $(OBJ)
|
||||
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||
|
||||
# Compilation rules
|
||||
|
||||
%.o:%.cpp
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) -c $<
|
||||
|
||||
%.d:%.cpp
|
||||
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||
|
||||
# Individual dependencies
|
||||
|
||||
DEPENDS = $(OBJ:.o=.d)
|
||||
include $(DEPENDS)
|
||||
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Reference in New Issue