(e5fc5259) · Commits · 郑智淋 / lammps

src/MAKE/Makefile.liberty_poems→src/MAKE/Makefile.liberty_poems_meam

+5 −4

Original line number	Diff line number	Diff line
		# liberty_poems = HP clust w/ dual Xeons, mpiCC, native MPI, FFTW, POEMS lib
		# liberty_poems_meam = HP cluster w/ dual Xeons, mpiCC, native MPI, FFTW, POEMS/MEAM libs

		SHELL = /bin/sh
		.IGNORE:
		@@ -11,9 +11,10 @@ CC = mpiCC
		CCFLAGS = -O -DFFT_FFTW -I${FFTW}/fftw -I/home/sjplimp/lammps/lib/poems
		DEPFLAGS = -M
		LINK = mpiCC
		LINKFLAGS = -O -L${FFTW}/fftw/.libs -L/home/sjplimp/lammps/lib/poems
		USRLIB = -lfftw -lpoems
		SYSLIB = -lstdc++ -lm
		LINKFLAGS = -O -L${FFTW}/fftw/.libs -L/home/sjplimp/lammps/lib/poems \
		-L/home/sjplimp/lammps/lib/meam -L/opt/intel/fc/9.0/lib
		USRLIB = -lfftw -lpoems -lmeam
		SYSLIB = -lstdc++ -lm -lifcore
		SIZE = size

		# Link rule

deleted100755 → 0

+0 −45

Original line number	Diff line number	Diff line
		# linux_poems = RedHat Linux box, Intel icc, MPICH, FFTW, POEMS library

		SHELL = /bin/sh
		#.IGNORE:

		# System-specific settings

		CC = icc
		CCFLAGS = -O -I/home/sjplimp/tools/mpich/include \
		-I/home/sjplimp/lammps/lib/poems \
		-I/home/sjplimp/tools/fftw/include -DFFT_FFTW -DGZIP
		DEPFLAGS = -M
		LINK = icc
		LINKFLAGS = -O -L/home/sjplimp/tools/mpich/lib \
		-L/home/sjplimp/lammps/lib/poems \
		-L/home/sjplimp/tools/fftw/lib
		USRLIB = -lfftw -lmpich -lpoems
		SYSLIB = -lstdc++ -lcxa -lunwind
		ARCHIVE = ar
		ARFLAGS = -rc
		SIZE = size

		# 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)

+6 −4

Original line number	Diff line number	Diff line
		# linux = RedHat Linux box, Intel icc, MPICH, FFTW, MEAM
		# linux_poems_meam = RedHat Linux box, Intel icc, MPICH, FFTW, POEMS & MEAM lib

		SHELL = /bin/sh
		#.IGNORE:
		@@ -7,15 +7,17 @@ SHELL = /bin/sh

		CC = icc
		CCFLAGS = -O -I/home/sjplimp/tools/mpich/include \
		-I/home/sjplimp/lammps/lib/poems \
		-I/home/sjplimp/tools/fftw/include -DFFT_FFTW -DGZIP
		DEPFLAGS = -M
		LINK = icc
		LINKFLAGS = -O -L/home/sjplimp/tools/mpich/lib \
		-L/home/sjplimp/tools/fftw/lib \
		-L/home/sjplimp/lammps/lib/poems \
		-L/home/sjplimp/lammps/lib/meam \
		-L/home/sjplimp/tools/fftw/lib \
		-L/opt/intel/fc/9.0/lib
		USRLIB = -lfftw -lmpich -lmeam
		SYSLIB = -lcxa -lunwind -lstdc++ -lifcore
		USRLIB = -lfftw -lmpich -lpoems -lmeam
		SYSLIB = -lstdc++ -lcxa -lunwind -lifcore
		ARCHIVE = ar
		ARFLAGS = -rc
		SIZE = size

0 → 100644

+60 −0

Original line number	Diff line number	Diff line
		# tbird = Dell cluster with dual 3.6 GHz Xeons, Intel mpicxx, native MPI, FFTW

		SHELL = /bin/sh
		.IGNORE:

		# System-specific settings

		# Openmpi on tbird does not work correctly with Lammps; mvapich should be used.
		# This is done through module commands.
		# fftw-2.1.5-openmpi-1.1.2-ofed-intel-9.1 can be used,
		# in spite of openmpi in the name.
		#
		# Before building Lammps on tbird, do the following two module commands:
		# "module switch mpi mpi/mvapich-0.9.8-ofed-intel-9.1"
		# "module load libraries/fftw-2.1.5-openmpi-1.1.2-ofed-intel-9.1"
		#
		# Before issuing a mpiexec command for Lammps,
		# the following commands are needed:
		# "source /opt/modules/3.1.6/init/bash"
		# "module switch mpi mpi/mvapich-0.9.8-ofed-intel-9.1"
		# "module load libraries/fftw-2.1.5-openmpi-1.1.2-ofed-intel-9.1"
		# If bash is not your shell, or the one specified in the script,
		# substitute the shell name for bash.

		CC = mpicxx
		CCFLAGS = -O -DFFT_FFTW -I${FFTW_INCLUDE}
		DEPFLAGS = -M
		LINK = mpicxx
		LINKFLAGS = -O -L${FFTW_LIB}
		USRLIB = -lfftw -lstdc++
		SYSLIB = -lm
		SIZE = size

		ARCHIVE = ar
		ARFLAGS = -rc

		# 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)