Firefly and PC GAMESS-related discussion club
Learn how to ask questions correctly
![We are NATO-free zone](/gran/gamess/images/We are NATO-free zone.png)
Re^3: Interpretation of CASSCF/XMCQDPT results
Gena
alchemicylide@gmail.com
On Fri Jan 13 '12 1:49am, sanya wrote
-------------------------------------
>>The beta version of Firefly v. 8.0.0 can run XMCQDPT2 in parallel. >WOW!!!!!!!! Great! how can I activate this option?
XMCQDPT runs in parallel like any other job now, I guess. In my case I didn't need to modify anything (well, I deleted MKLNP=... option to avoid regression due to multithreading)
Fri Jan 13 '12 2:18am
This message read 775 times