Firefly and PC GAMESS-related discussion club

Learn how to ask questions correctly  
We are NATO-free zone

Re^9: Parallel geometry optimization with XMC-QDPT2

Igor Polyakov

Dear Dawid,

>I was not aware of that. How to use these features, then?

I would suggest to actually read the manual (full manual pdf). At least the (X)MCQDPT section. Usage of smppar option is documented there+all $smp group keywords are documented in the end of manual, just use find option in the pdf reader.

Best regards, Igor

[ Previous ] [ Next ] [ Index ]           Fri Dec 30 '16 11:24am
[ Reply ] [ Edit ] [ Delete ]           This message read 118 times