1.准备好安装包VASP5.4.42. VASP安装前的准备 InstallGNUCompilersudoapt-getinstallmakebuild-essentialg++gfortran InstallrequiredVASPlibraries(lapack,scalapack,openmpi,andfftw)sudoapt-getinstalllibblas-devliblapack-devlibopenmpi-devlibscalapack-mpi-devlibfftw3-dev3. VASP安装  提取并修补  打开vasp压缩包所在文件夹，进行一下四步tar-zxvfvasp.