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Re^2: MP2/6-311G**
gensz
genoffrie@gmail.com
On Mon Feb 13 '12 3:00pm, sanya wrote
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>On Mon Feb 13 '12, gensz wrote
>------------------------------
>>I'm having a problem with calculating the energy for MP2/6311-G**
>>because this is what it says when i run the input file : ILLEGAL EXTENDED BASIS FUNCTION REQUESTED >Please show the head of the input file. In particular, group $GBASIS is of interest.
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Mon Feb 13 '12 3:58pm
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