epsmat_old2hdf5
epsmat_old2hdf5
code input format (epsmat_old2hdf5.inp
)
epsmat ! Name of input file epsmat.h5 ! Name of output file WFN ! Name of wave function file to extract header from icutv ! truncation flag (0=no truncation, 2=spherical, 4=wire, 5=box, 6=slab) truncval ! truncation radius, for spherical truncation. Otherwise, ignored