Alex Granovsky
gran@classic.chem.msu.su
the point is defined by the keyword WHERE of $ELMOM group.
WHERE = COMASS - center of mass (default) NUCLEI - at each nucleus POINTS - at points given in $POINTS. ORIGIN - at the coordinate system origin
The default point is indeed the center of mass.
Hope this helps.
Kind regards,
Alex Granovsky
On Tue Apr 25 '17 4:30pm, GrEv wrote
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>Hello,
>I wonder, with respect to which point the permanent dipole moment is calculated? Is it the center of mass?
>Best regards,
>Evgeniy