Publication: Higher Electric Multipole Moments for Some Polyatomic Molecules From Accurate SCF Calculations
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Abstract
Higher electric multipole moments for the ground-state electronic configuration of some polyatomic molecules, i.e. CH<inf>4</inf>, NH<inf>3</inf>, H<inf>2</inf>O, 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 and experimental ones.
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Source
Communications in Theoretical Physics
Volume
38
Issue
4
Start Page
489
End Page
492
