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Beyond the Thomas-Fermi-Weizsäcker-Dirac theory of electronic structure

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Recent Progress in Many-Body Theories

Part of the book series: Lecture Notes in Physics ((LNP,volume 198))

Abstract

A universal energy functional which depends only on the charge density operator p and which approximates the Hartree-Fock energy expression, is advanced. This functional, whose construction is based on the use of Harriman's orbitals, goes beyond the usual plane-wave approximations. Closed analytic expressions for the kinetic and exchange energies, are presented

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H. Kümmel M. L. Ristig

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© 1984 Springer-Verlag

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Ludeña, E.V., de Química, C. (1984). Beyond the Thomas-Fermi-Weizsäcker-Dirac theory of electronic structure. In: Kümmel, H., Ristig, M.L. (eds) Recent Progress in Many-Body Theories. Lecture Notes in Physics, vol 198. Springer, Berlin, Heidelberg. https://doi.org/10.1007/BFb0037575

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  • DOI: https://doi.org/10.1007/BFb0037575

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  • Publisher Name: Springer, Berlin, Heidelberg

  • Print ISBN: 978-3-540-12924-0

  • Online ISBN: 978-3-540-38808-1

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