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Average inner product sums of electron linear momenta for atoms and ions
Authors:Hisashi Matsuyama  Toshikatsu Koga
Institution:(1) Department of Applied Chemistry, Muroran Institute of Technology, Muroran, Hokkaido 050-8585, Japan, JP
Abstract:From the second moments of the electron-pair densities in momentum space, accurate Hartree–Fock values of the average inner product sum 〈∑ i<j p i ·p j 〉 of electron linear momenta are evaluated for the 102 neutral atoms from He to Lr, the 53 singly charged cations from Li+ to Cs+, and the 43 stable anions from H to I in their experimental ground states. The present results are new for 38 species and improve the literature values for 68 species. Received: 18 July 2002 / Accepted: 4 September 2002 / Published online: 8 November 2002 Acknowledgement. This work was supported in part by a Grant-in-Aid for Scientific Research from the Ministry of Education of Japan. Correspondence to: H. Matsuyama e-mail: hisashi@mmm.muroran-it.ac.jp
Keywords:: Inner products of linear momenta –  Electron-pair densities –  Neutral atoms –  Singly charged ions
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