Firefly and PC GAMESS-related discussion club


 
Learn how to ask questions correctly  
 
 
We are NATO-free zone
 


Re: mean gradient charges ($MGC group)

Alex Granovsky
gran@classic.chem.msu.su

Dear Anna,

no it is impossible with Firefly.

Kind regards,
Alex Granovsky


On Thu Feb 13 '14 5:48pm, anna wrote
------------------------------------
>Dear all,

>Is it possible to calculate mean gradient charges ($MGC group) in Firefly? In the manual I only found ESP charges calculations.

>Kind regards,
>Anna

[ Previous ] [ Next ] [ Index ]           Thu Feb 13 '14 6:25pm
[ Reply ] [ Edit ] [ Delete ]           This message read 687 times