Molcas Forum
Support and discussions for Molcas and OpenMolcas users and developers
You are not logged in.
- Topics: Active | Unanswered
Announcement
Welcome to the Molcas forum.
Please note: The forum's URL has changed. The new URL is: https://molcasforum.univie.ac.at. Please update your bookmarks!
You can choose an avatar and change the default style by going to "Profile" → "Personality" or "Display".Pages: 1
#1 2019-03-27 01:57:46
- daishudaishu
- Member
- Registered: 2019-02-24
- Posts: 22
SCF functional for CASPT2 calculation
Dear all,
I am doing CASPT2 calculations for UV/X-ray absorption. I notice that I can choose different SCF functionals. Does the functional make a difference for the CASPT2 calculation?
Thanks!
Offline
Pages: 1
Last refresh: Today 03:38:01