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Local Density Approximations in Quantum Chemistry and Solid State Physics

Jens Peder Dahl, John Avery




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 |  2013-06-23 | Original language:English | PDF # 1 |  10.03 x1.07 x7.05l,2.07 | File type: PDF | 851 pages

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The· simplest picture of an atom, a molecule or a solid is the picture of its distribution of charge. It is obtained by specifying the positions of the atomic nuclei and by showing how the density, p(E), of the electronic charge-cloud varies from place to place. A much more detailed picture is provided by the many-electron wavefunction. This quantity shows not only the arrangement of the electrons with respect to the nuclei, but also the arrangement of the electro...

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