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- W2045270117 abstract "The immersion energy of an inert-gas atom or ${mathrm{H}}_{2}$ molecule into jellium is calculated using an electron-gas approximation. Our modification of the energy functional of Gordon and Kim [J. Chem. Phys. 56, 3122 (1972)] includes a correction to remove the self-exchange term from the exchange energy and adjustments to take into account the nonuniformity of the system. The calculated ratio of the immersion energy to the jellium density varies about a factor of 2 over five orders of magnitude variation in jellium density and agrees relatively well (within a factor of 2) with the result of previous density-functional approaches in the low-density limit; the Gordon-Kim model is not reliable, however." @default.
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- W2045270117 date "1989-08-01" @default.
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- W2045270117 title "Immersion of an inert-gas atom or<mml:math xmlns:mml=http://www.w3.org/1998/Math/MathML display=inline><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant=normal>H</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub></mml:mrow></mml:math>molecule into jellium: Modified electron-gas approach" @default.
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- W2045270117 doi "https://doi.org/10.1103/physreva.40.1153" @default.
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