[molpro-user] how to get out the MO integrals?
Dongxia Ma
tamuer at gmail.com
Wed Jan 31 17:20:45 GMT 2007
Dear molpro users,
I'm trying to use the MO integrals of state-averaged MCSCF from MOLPRO in
our own program. I know how to print out the 2-electron AO integrals but
don't know how to save/load/print/use the MO integrals. Can anyone give any
suggestion? Thanx in advance.
Dongxia
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://www.molpro.net/pipermail/molpro-user/attachments/20070131/c57d1c6b/attachment.html>
More information about the Molpro-user
mailing list