Alexei Popov
alexei.a.popov@gmail.com
the diffuse functions are usually even more important on oxygen atoms than on nitrogens...
-Alexei
On Mon Nov 16 '09 1:39pm, Sergey wrote
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>Dear all,
>adding functions to N is a recognized way to extend accuracy while saving computational time, what about O atoms then? I study adenine stacked systems.
>Thank you!
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