Loading doc/src/Build_settings.txt +5 −3 Original line number Diff line number Diff line Loading @@ -33,7 +33,7 @@ LAMMPS can use them if they are available on your system. [CMake variables]: -D FFT=value # FFTW3 or MKL or KISS, default is FFTW3 if found, else KISS -D FFT=value # FFTW3 or MKL or KISS or CUFFT, default is FFTW3 if found, else KISS -D FFT_SINGLE=value # yes or no (default), no = double precision -D FFT_PACK=value # array (default) or pointer or memcpy :pre Loading @@ -51,7 +51,7 @@ the FFT library, you can set these variables: [Makefile.machine settings]: FFT_INC = -DFFT_FFTW3 # -DFFT_FFTW3, -DFFT_FFTW (same as -DFFT_FFTW3), -DFFT_MKL, or -DFFT_KISS FFT_INC = -DFFT_FFTW3 # -DFFT_FFTW3, -DFFT_FFTW (same as -DFFT_FFTW3), -DFFT_MKL, -DFFT_FFTW_THREADS, -DFFT_CUFFT, or -DFFT_KISS # default is KISS if not specified FFT_INC = -DFFT_SINGLE # do not specify for double precision FFT_INC = -DFFT_PACK_ARRAY # or -DFFT_PACK_POINTER or -DFFT_PACK_MEMCPY :pre Loading @@ -61,8 +61,10 @@ FFT_INC = -I/usr/local/include FFT_PATH = -L/usr/local/lib FFT_LIB = -lfftw3 # FFTW3 double precision FFT_LIB = -lfftw3 -lfftw3f # FFTW3 single precision FFT_LIB = -lfftw3 -lfftw3_omp # FFTW3 double precision, OpenMP threaded using the KOKKOS package FFT_LIB = -lmkl_intel_lp64 -lmkl_sequential -lmkl_core # MKL with Intel compiler FFT_LIB = -lmkl_gf_lp64 -lmkl_sequential -lmkl_core # MKL with GNU compier :pre FFT_LIB = -lmkl_gf_lp64 -lmkl_sequential -lmkl_core # MKL with GNU compiler FFT_LIB = -lcufft # cuFFT (for GPUs using the KOKKOS package) :pre As with CMake, you do not need to set paths in FFT_INC or FFT_PATH, if make can find the FFT header and library files. You must specify Loading Loading
doc/src/Build_settings.txt +5 −3 Original line number Diff line number Diff line Loading @@ -33,7 +33,7 @@ LAMMPS can use them if they are available on your system. [CMake variables]: -D FFT=value # FFTW3 or MKL or KISS, default is FFTW3 if found, else KISS -D FFT=value # FFTW3 or MKL or KISS or CUFFT, default is FFTW3 if found, else KISS -D FFT_SINGLE=value # yes or no (default), no = double precision -D FFT_PACK=value # array (default) or pointer or memcpy :pre Loading @@ -51,7 +51,7 @@ the FFT library, you can set these variables: [Makefile.machine settings]: FFT_INC = -DFFT_FFTW3 # -DFFT_FFTW3, -DFFT_FFTW (same as -DFFT_FFTW3), -DFFT_MKL, or -DFFT_KISS FFT_INC = -DFFT_FFTW3 # -DFFT_FFTW3, -DFFT_FFTW (same as -DFFT_FFTW3), -DFFT_MKL, -DFFT_FFTW_THREADS, -DFFT_CUFFT, or -DFFT_KISS # default is KISS if not specified FFT_INC = -DFFT_SINGLE # do not specify for double precision FFT_INC = -DFFT_PACK_ARRAY # or -DFFT_PACK_POINTER or -DFFT_PACK_MEMCPY :pre Loading @@ -61,8 +61,10 @@ FFT_INC = -I/usr/local/include FFT_PATH = -L/usr/local/lib FFT_LIB = -lfftw3 # FFTW3 double precision FFT_LIB = -lfftw3 -lfftw3f # FFTW3 single precision FFT_LIB = -lfftw3 -lfftw3_omp # FFTW3 double precision, OpenMP threaded using the KOKKOS package FFT_LIB = -lmkl_intel_lp64 -lmkl_sequential -lmkl_core # MKL with Intel compiler FFT_LIB = -lmkl_gf_lp64 -lmkl_sequential -lmkl_core # MKL with GNU compier :pre FFT_LIB = -lmkl_gf_lp64 -lmkl_sequential -lmkl_core # MKL with GNU compiler FFT_LIB = -lcufft # cuFFT (for GPUs using the KOKKOS package) :pre As with CMake, you do not need to set paths in FFT_INC or FFT_PATH, if make can find the FFT header and library files. You must specify Loading
