lammps安裝步驟詳解(編輯修改稿)
2025-02-03 11:56 本頁面
【文章內(nèi)容簡(jiǎn)介】 settings specify flags and libraries needed for your piler CC = g++4 g++4改為 mpic++ CCFLAGS = g O DEPFLAGS = M LINK = g++4 g++4改為 mpic++ LINKFLAGS = g O LIB = ARCHIVE = ar ARFLAGS = rc SIZE = size LAMMPSspecific settings specify settings for LAMMPS features you will use LAMMPS ifdef options, see doc/ LMP_INC = DLAMMPS_GZIP MPI library, can be src/STUBS dummy lib INC = path for , MPI piler settings PATH = path for MPI library LIB = name of MPI library MPI_INC = I/opt/mpich/include DMPICH_SKIP_MPICXX MPI_PATH = I/opt/mpich/lib MPI_LIB = /opt/mpich/lib/ lmpich lpthread FFT library, can be DFFT_NONE if not using PPPM from KSPACE package INC = DFFT_FFTW, DFFT_INTEL, DFFT_NONE, etc, FFT piler settings PATH = path for FFT library LIB = name of FFT library FFT
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