[molpro-user] print Configuration State Functions
Kaveh Haghighi Mood
haghighi at pc.rwth-aachen.de
Sun Feb 23 21:03:42 GMT 2014
Dear all,
I want to print Configuration State Functions and to be more precise
determinants, CI coefficients and also coupling coefficients for a
CASSCF calculation. I already tried this keywords:
Gprint,civector;
Gprint,ref;
print,ref
together with
config,CSF;
Any clarification about output appreciated,
Thanks in advance,
Kaveh Haghighi Mood
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://www.molpro.net/pipermail/molpro-user/attachments/20140223/a8842b1a/attachment.html>
More information about the Molpro-user
mailing list