optimization in DFT-D3

From NWChem

You are viewing a single post from the thread title above
Jump to: navigation, search
Forum >> NWChem's corner >> General Topics >> optimization in DFT-D3

Click here for full thread
Gets Around
Threads 35
Posts 105
10:26:45 AM PDT - Mon, May 6th 2013
Hi,

Is it possible to optimize geometry using DFT-D3?
If so, could you be so kind to give an example?


Who's here now Members 0 Guests 0 Bots/Crawler 0

AWC's: 2.5.10 MediaWiki - Stand Alone Forum Extension
Forum theme style by: AWC
Retrieved from "http://www.nwchem-sw.org/index.php/Special:AWCforum/sp/id3005"