[molpro-user] Origin

lilianna bryjko lbryjko at yahoo.com
Thu Nov 3 16:32:20 GMT 2011


Hi,


I would like to ask about origin of dm and qm in Molpro. My output shows:
OPERATOR DM      FOR CENTER  0  COORDINATES:    0.000000    0.000000    0.000000
OPERATOR SM      FOR CENTER  0  COORDINATES:    0.000000    0.000000    0.000000
OPERATOR QM      FOR CENTER  0  COORDINATES:    0.000000    0.000000    0.000000

My Z-matrix there are cartesian coordinates. Is
 this point 0 0 0 on the axis or origin of mass or charge?

Best wishes,

Lilianna
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