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Re: Calculation of NBO Charges

Alex Granovsky
gran@classic.chem.msu.su


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.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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