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Автор B Schiff
Дата выпуска 1954-01-01
dc.description A potential function is computed for the lithium ion core, and is used to calculate the cohesive energy of metallic lithium, which is found to be in good agreement with experiment. Eigenvalues for conduction electrons in metallic lithium are calculated for points of high symmetry in the Brillouin zone, using the improved cellular method of Howarth and Jones, in which boundary conditions are applied at a large number of points on the surface of the atomic polyhedron; the merits of this type of boundary condition are discussed. The energy gap at the centre of a face of the zone is found to be 2.57 eV, the lowest state at that point having a p-like symmetry, and the interpretation of the soft x-ray emission spectrum of lithium is discussed in the light of this result.
Формат application.pdf
Издатель Institute of Physics Publishing
Название A Calculation of the Eigenvalues of Electronic States in Metallic Lithium by the Cellular Method
Тип paper
DOI 10.1088/0370-1298/67/1/302
Print ISSN 0370-1298
Журнал Proceedings of the Physical Society. Section A
Том 67
Первая страница 2
Последняя страница 8
Аффилиация B Schiff; Department of Mathematics, Imperial College, London
Выпуск 1

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