Firefly and PC GAMESS-related discussion club


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



Re^2: C-type auxiliary basis sets for Dunning's basis sets?

Michal Krompiec
michal.krompiec@merckgroup.com


Dear Alex,
I confirm this is working.
Thanks,
Michal


On Wed May 30 '18 9:36pm, Alex Granovsky wrote
----------------------------------------------
>Dear Michal,

>These basis sets can be found in EMSL Basis Set Exchange Library.
>You can find them attached to this post, already in the proper format.
>Please let us know how they works for you. If they do, I'll put them
>into Firefly's download area.

>Hope this helps.

>Best regards,
>Alex Granovsky
>
>
>
>On Tue May 29 '18 12:03pm, Michal Krompiec wrote
>------------------------------------------------
>>Hi, where can I find auxiliary basis sets (for RI-XMCQDPT2) to be used with Dunning's correlation consistent bais sets? Will this work: https://github.com/susilehtola/erkale/blob/master/basis/aug-cc-pVTZ-JK.gbs ?
>>Best,
>>Michal


[ Previous ] [ Next ] [ Index ]           Mon Jun 4 '18 1:27pm
[ Reply ] [ Edit ] [ Delete ]           This message read 329 times