Title of article
Accurate Roothaan-Hartree-Fock momentum expectation values for ground states of the atoms He to Xe
Author/Authors
de la Vega، نويسنده , , J.M.Garcيa and Miguel، نويسنده , , B.، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 1995
Pages
5
From page
616
To page
620
Abstract
Two new sets of RHF wavefunctions with more accurate energies for the ground states of atoms up to Z = 54 have been published. We report momentum space properties calculated from these new RHF wavefunctions and compare them with those obtained previously for the atoms He to Xe. The behaviour and validity of the powers of 〈pn〉 through the periodic system are analyzed in order to select adequate RHF wavefunctions in momentum space.
Journal title
Chemical Physics Letters
Serial Year
1995
Journal title
Chemical Physics Letters
Record number
1770918
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