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Rydberg states of the helium atom

Deng, Jia; Gilbert, Andrew; Gill, Peter

Description

Using the recently introduced maximum overlap method and Hartree-Fock Perturbation Theory (HFPT), we compute Hartree-Fock (HF) wavefunctions for triplet 1s ns states of the helium atom. Comparison with near-exact results from Nakatsuji's free ICI method reveals that HF theory provides a simple route to accurate energies of these Rydberg states, especially for large n.

CollectionsANU Research Publications
Date published: 2009
Type: Journal article
URI: http://hdl.handle.net/1885/56482
Source: International Journal of Quantum Chemistry
DOI: 10.1002/qua.22015

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