If a different version of MPI is used, you have to supply the compile and linkįlags to the C compiler with -with-mpicompile and -with-mpilink. If you are using openmp, specify -with-mpi=omp. It has been tested with lammpi and openmp. You can build with MPIĮnabled using the option -with-mpi=***, where *** is the MPI implementation Some of the functions have a parallel version using MPI. This dir only affects the installation of SFAC executables. If the default /usr/local is not what you want, specify -prefix=my/dir. See faclib/cfortran.doc for supported F77 compilers. If your F77 compiler is not g77 or sun's f77, specify the option enable-copt=*** and -enable-fopt=*** respectively if desired. Supply the optimization option for C and F77 compilers with If your F77 compiler is not g77, then you need to supply the PIC Independent code) option with -enable-cpic=***.

If your C compiler is not gcc, then you need to supply the PIC (position You may need to specify some of the following options depending on your

The other interface uses a simple command parser, compiled into executables. Of the Python scripting language, implemented as a package 'pfac'. There are two interfaces available to the FAC numerical lib.

A software packge for the calculation of various atomic processes.

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