# linux = RedHat Linux box, Intel icc, MPICH2, FFTW SHELL = /bin/sh # --------------------------------------------------------------------- # compiler/linker settings # specify flags and libraries needed for your compiler CC = mpic++ CCFLAGS = -O2 -fopenmp -std=c++11\ -funroll-loops -fstrict-aliasing -Wall -W -Wno-uninitialized -restrict SHFLAGS = -fPIC DEPFLAGS = -M LINK = mpic++ LINKFLAGS = -O LIB = -lstdc++ SIZE = size ARCHIVE = ar ARFLAGS = -rcsv SHLIBFLAGS = -shared # --------------------------------------------------------------------- # LAMMPS-specific settings # specify settings for LAMMPS features you will use # if you change any -D setting, do full re-compile after "make clean" # LAMMPS ifdef settings, OPTIONAL # see possible settings in doc/Section_start.html#2_2 (step 4) LMP_INC = -DLAMMPS_GZIP -DLAMMPS_JPEG # MPI library, REQUIRED # see discussion in doc/Section_start.html#2_2 (step 5) # can point to dummy MPI library in src/STUBS as in Makefile.serial # 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 -lmpl -lpthread MPI_INC = #-I/usr/local/packages/openmpi/1.9a1r27668/Intel-13.0.0-CUDA-4.2.9/include MPI_PATH = #-L/usr/local/packages/openmpi/1.9a1r27668/Intel-13.0.0-CUDA-4.2.9/lib MPI_LIB = #-lmpi -lpthread # FFT library, OPTIONAL # see discussion in doc/Section_start.html#2_2 (step 6) # 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 FFT_INC = -DFFT_FFTW3 -I/usr/local/packages/fftw/3.3.3/INTEL-140-MVAPICH2-2.0/include FFT_PATH = -L/usr/local/packages/fftw/3.3.3/INTEL-140-MVAPICH2-2.0/lib FFT_LIB = -lfftw3 # JPEG library, OPTIONAL # see discussion in doc/Section_start.html#2_2 (step 7) # only needed if -DLAMMPS_JPEG listed with LMP_INC # INC = path for jpeglib.h # PATH = path for JPEG library # LIB = name of JPEG library JPG_INC = -I/usr/lib64/include JPG_PATH = -L/usr/lib64 JPG_LIB = -ljpeg # --------------------------------------------------------------------- # build rules and dependencies # no need to 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) $< > $@ # Individual dependencies DEPENDS = $(OBJ:.o=.d) sinclude $(DEPENDS)