[molpro-user] SOC error
t.leyssens at chim.ucl.ac.be
t.leyssens at chim.ucl.ac.be
Tue Jan 16 12:34:02 GMT 2007
I receive an error for my SOC stating
error in 1-elec all internal so
-23.9053688620146 -23.8987849416113
What does this mean? How do I solve this
See also
http://www.molpro.net/molpro-user/archive/all/msg00621.html
and
http://www.molpro.net/molpro-user/archive/all/msg01948.html
Leyssens Tom
Post-doctoral researcher
Max-Planck-Institut für Kohlenforschung
Kaiser-Wilhelm-Platz 1
45470 Mülheim an der Ruhr
Germany
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