Next: 9.2 Reading sorted AO Up: 9 AO integral interface Previous: 9 AO integral interface

9.1 Computing AO integrals


checks if integrals for current basis and geometry are available,
and computes them when necessary.

Input:

iskp=0
compute one- and two-electron integrals
iskp=1
compute one-electron integrals only



P.J. Knowles and H.-J. Werner
molpro-support@tc.bham.ac.uk
Jan 10, 2000