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ambivalentno

Showing posts with label PCM. Show all posts
Showing posts with label PCM. Show all posts

Thursday, November 19, 2009

Coupled clusters@GAMESS

Dear Santa!
I'm really sad because of absence of PCM interface in coupled-clusters. Also I'd like to have G3MP2 for open-shell structures and less memory-confusing coupled clusters code. Oh, forgotten: parallelisation of cc for open-shell systems))
Yours, Nikita Khlestov)
Posted by Unknown at 5:08 PM 0 comments
Labels: letter for Santa, open shell systems, PCM, quantum chemistry
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