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Re^3: Calculation of NBO Charges

Amir Nasser Shamkhali
amir_n_shamkhali@yahoo.com


Dear Jim
The version of NBO is not important. Buying of NBO is difficult for me due to many problems for money transfer from Iran to other countries. I need only NBO charges to calculate Fukui functions.

Best wishes



On Sat Aug 24 '13 0:45am, Jim Kress wrote
-----------------------------------------
>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.htmlhttp://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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