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Re: Basis set for Solvent calculation with Cavity Radius Modification

Alex Granovsky

Dear Farid,

attached please find the corrected input and output files.

There were several problems with your original input file,
the most important of them was missed $contrl ecp=read directive.

Hope this helps.

Kind regards,
Alex Granovsky

On Mon Mar 10 '14 10:48am, taherkhani wrote
>Dear Alex,

>Thanks so much for your consideration.I am sorry for delay response. Attached please find basis set for solvent calculation of Re complex compound with cavity radius modification.  I really appreciate your help.

>All the best,


This message contains the 838 kb attachment
[ pcm_with_ecp_fixed.rar ]

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