[Pw_forum] how to get the results of atomic dipole and quadrupole moment
shuixblue at hotmail.com
Sun Dec 3 09:50:32 CET 2006
Does anyone can shed light on me how to get the results of atomic dipole
and quadrupole moment(the direction pointing outwards of the surface) when
adatom adsorption on the nonpolar-slab surface(one-side model) using pwscf?
I searched out some relative information in maillist, but few can help me
solve the problem. Much guidance and direction is deeply appreciated.
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