Re: Analytical CD gradient in Molcas 7.4?


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Posted by Roland Lindh on June 03, 2009 at 14:15:22:

In Reply to: Re: Analytical CD gradient in Molcas 7.4? posted by Francesco Aquilante on June 03, 2009 at 13:34:51:

Hi,
a more optimistic view is that analytic CD-HF gradients will be much earlier than 8.0. If all goes according to plans it should be available before the end of this summer. Analytic CD-CASSCF gradients should come during the fall.

Take care,

-roland



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