[molpro-user] defining basis set
dodong70 at yahoo.com
Fri Jun 23 19:00:57 BST 2006
Dear Molpro users,
I used to have no trouble using this basis set
definition in ver. 2002.6:
Now in ver. 2006.1, I cannot seem to use it even if I
rewrite it in the BASIS....END format. The trouble is
that it cannot seem to recognize "N9" and "H13"as they
are in my z-matrix. I don't want all the nitrogen and
hydrogen atoms to use an extended basis set. Just N9
How do I do this?
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