[molpro-user] SAPT with Frozen Core

[Neeraj Rai]

Hi,

   I was wondering SAPT implementation in MolPro can handle frozen core
approximation/ECP as presented in the article:

J Chem Phys. <javascript:AL_get(this,%20'jour',%20'J%20Chem%20Phys.');> 2007
Oct 28;127(16):164103

    Thanks.


-- 
Regards,
Neeraj.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://www.molpro.net/pipermail/molpro-user/attachments/20091002/7a407a77/attachment.html>