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[求助]
VASP安装出错，请问大佬fpp命令未找到是什么原因啊已有2人参与
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VASP安装出错，请问大佬下面的出错原因是什么啊 if [ ! -d build/std ] ; then mkdir build/std ; fi; \ cp src/makefile src/.objects makefile.include build/std ; \ make -C build/std VERSION=std all make[1]: 进入目录“/opt/vasp/vasp.6.1.2_patched/build/std” rsync -ru ../../src/lib . cp makefile.include lib make -C lib -j1 make[2]: 进入目录“/opt/vasp/vasp.6.1.2_patched/build/std/lib” make libdmy.a make[3]: 进入目录“/opt/vasp/vasp.6.1.2_patched/build/std/lib” fpp -f_com=no -free -w0 preclib.F preclib.f90 make[3]：fpp：命令未找到 make[3]: *** [makefile:25：preclib.f90] 错误 127 make[3]: 离开目录“/opt/vasp/vasp.6.1.2_patched/build/std/lib” make[2]: *** [makefile:18：all] 错误 2 make[2]: 离开目录“/opt/vasp/vasp.6.1.2_patched/build/std/lib” make[1]: *** [makefile:156：lib] 错误 2 make[1]: 离开目录“/opt/vasp/vasp.6.1.2_patched/build/std” make: *** [makefile:6：std] 错误 2 |
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3楼2021-06-20 17:38:27
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bashrc： export PATH=/usr/local/openmpi/bin:$PATH export LD_LIBRARY_PATH=/usr/local/openmpi/lib/:$LD_LIBRARY_PATH export PATH=$PATH:/home/mccc-lsl/qe-6.7/bin export f90=/opt/intel/oneapi/compiler/2021.2.0/linux/bin/intel64/ifort export PATH=/opt/intel/oneapi/compiler/2021.2.0/linux/bin/intel64:$PATH export PATH=/opt/intel/oneapi/compiler/:$PATH source /opt/intel/oneapi/setvars.sh intel64 # openmpi 3.1.3 environment variable if [ -f /opt/intel/bin/ifortvars.sh ]; then source /opt/intel/bin/ifortvars.sh intel64 2> /dev/null export MPI=home/mccc-lsl/openmpi-3.1.3 export PATH=$MPI/bin:$PATH export LD_LIBRARY_PATH=$MPI/lib:$LD_LIBRARY_PATH export MANPATH=$MANPATH:$MPI/share/man export INFOPATH=$INFOPATH:$MPI/share/man fi export LD_LIBRARY_PATH=/opt/fftw-3.3.9/lib:$LD_LIBRARY_PATH export LDLIBS="-L/opt/fftw-3.3.9/lib -lfftw3" source /opt/intel/oneapi/compiler/2021.2.0/linux/bin/intel64/ifort |
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