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Re: New feature in Aimall

Anton Cherkasov
ach@iomc.ras.ru


This issue was discussed here:
AIM extended wavefunction file or Gaussian checkpoint file

On Mon Nov 1 '10 12:02pm, Vyacheslav wrote
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>Hi,
>in comments to the 10.10.11 version of Aimall (http://aim.tkgristmill.com/knownissues.html) I have seen such lines: "Wavefunctions derived from effective core potential (ECP) calculations must include additional core density function data for the ECP-modeled core electrons".
>Is it introduce into FF?
>Thanks in advance,
>Vyacheslav


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