PC GAMESS-related discussion club


Basis set

Alexandre M Dias
alexandre.dias@unifenas.br


Hi all

How I do N2 single point RHF calculation without symmetry (C1) with cc-pVQZ basis set ?
I  am asking because the Gamess return a error message: incapacity to calculate integrals to M and N shells.

[ This message was edited on Thu Oct 9 '08 by the author ]


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