[molpro-user] Transition density matrices from CASSCF

[lilianna bryjko]

Hi,

I performed CASSCF calculations with Cs symmetry on uracil. I would like to ask how I can save transition density matrices for example: for 1.2-1.1 or 3.2-2.1
transition from my calculations. I noticed that dm option print only charge density matrices.


Best wishes,
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://www.molpro.net/pipermail/molpro-user/attachments/20110912/59b39a23/attachment.html>