Program g90cnv

This program converts the GAUSSIAN90 basis sets and orbitals to the format used in the EPolyScat programs

Input data records

  1. iuin, iugeom, iuorb
  2. ecenter

Definition of the input variables

iuin
Input unit which contains GAUSSIAN90 output
iugeom
Output unit for molecular geometry information
iuorb
Output unit for basis set and orbital expansion coefficient information
ecenter(3)
Location of the center of the single center expansion