[molpro-user] Can quasi-diabatic densities be saved for property evaluation?

Seth Olsen seth.olsen at uq.edu.au
Tue Dec 18 00:47:06 GMT 2012


Hi Molproers,

I was wondering if it was possible to save the densities of quasi-diabatic states in DDR for e.g. property evaluation.

Cheers,

Seth

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Seth Olsen
ARC Australian Research Fellow
6-431 Physics Annexe
School of Mathematics and Physics
The University of Queensland
Brisbane QLD 4072 Australia
seth.olsen at uq.edu.au
+61 7 3365 2816
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Unless stated otherwise, this e-mail represents only the views of the Sender and not the views of The University of Queensland

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