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Re^2: Calculation of NBO Charges

Jim Kress
jimkress_35@kressworks.com


Alex,

Is this v5 or v6 of NBO?

Jim

On Fri Aug 23 '13 11:03am, Alex Granovsky wrote
-----------------------------------------------
>Dear Amir,

>It is possible to calculate NBO charges with Firefly using
>Firefly's NBO module. You need to buy the NBO license first
>(it is inexpensive, ca. $ 35) from TCI/NBO. See the following
>link for additional information:

>http://classic.chem.msu.su/gran/gamess/nbo.htmlhttp://classic.chem.msu.su/gran/gamess/nbo.html
>
>
>Kind regards,
>Alex Granovsky
>
>
>
>On Thu Aug 22 '13 2:51pm, Amir Nasser Shamkhali wrote
>-----------------------------------------------------
>>Dear All
>>Is it possible to calculate only NBO charges by firefly?


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