Re: How to Use MECP


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Posted by Roland Lindh on August 24, 2005 at 09:45:35:

In Reply to: How to Use MECP posted by stringbell on August 24, 2005 at 05:17:17:

Hi Stringbell,
note first that minimum energy cross points cannot be used for conical intersections (yet!). I recommed you to look into Test/input/test436.input for an example.

-roland


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