Ni ANO-RCC
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Just Got Here
12:41:00 PM PDT - Thu, Sep 17th 2015
Quote:PrimeFan
Sep 11th 10:05 pm
So I think some kind of linear dependency problems do occur in the ANO-RCC basis set.
I was wrong. Rev.D01 does not reproduce the bug. All is OK with the basis set. Sorry for the inconvenience.