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Higher Electric Multipole Moments for Some Polyatomic Molecules from Accurate SCF Calculations
Authors:Telhat Ozdogan
Affiliation:Department of Physics, Education Faculty, Ondokuz Mayis University, Amasya, Turkey
Abstract:Higher electric multipole moments for the ground-state electronic configuration of some polyatomicmolecules, i.e. CH4, NH3, H2O, were calculated from SCF-HFR wavefunctions using Slater-type orbital basis sets.The calculated results for electric multipole moments of these molecules are in good agreement with the theoretical andexperimental ones.
Keywords:electric multipole moments   Slater-type orbitals   HFR approximation
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