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Multipole electrostatic potential derived atomic charges in NDDO-methods with spd-basis sets.

Horn, Anselm H C

Multipole electrostatic potential derived atomic charges in NDDO-methods with spd-basis sets. [electronic resource] - Journal of molecular modeling Feb 2007 - 381-92 p. digital

Publication Type: Journal Article

ISSN: 0948-5023

Standard No.: 10.1007/s00894-006-0137-8 doi

Subjects--Topical Terms:
Models, Chemical
Models, Molecular
Static Electricity

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