Sunday, September 19, 2021

SUPERPOSITION OF CONFIGURATIONS: THE HELIUM ATOM*

 By G.RUSSELL TAYLORt AND ROBERTG.PARR

 Communicated by R.S.Mulliken,January7,195

 

 Introduction.

-A very nearly exact approximation to the ground state wavefunction for the helium atom was obtained by Hylleraas in 1930.1His approximation is so accurate that calculation of the ground state wavefunction and energy for helium no longer remains an interesting problem perse,but  the extension of his method beyond two-electron problems is quite hopeless.2 The work reported in the present paper the refore was under taken as a step in the development of a systematic, practical  procedure for obtaining an accurate wavefunction for any atom or molecule.

 

https://www.pnas.org/content/pnas/38/3/154.full.pdf 

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