A self-consistent model calculation of the electronic structure of ordered,disordered and hydrogenated Pd3Fe |
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| Authors: | M.H.Preis Corrêa A. Vasquez C.E.T. Gonçalves da Silva |
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| Affiliation: | Instituto de Física, Universidade Federal do Rio Grande do Sul, 90000 Porto Alegre, RS, Brasil;Instituto de Física “Gleb Wataghin”, UNICAMP, 13100 Campinas, SP, Brasil |
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| Abstract: | We study, within the Bethe lattice approximation, the electronic structure of the ordered, disordered and hydrogenated intermetallic Pd3Fe. We employ a simple one-orbital per site model hamiltonian, which includes a Hubbard-like Coulomb interaction term. This is treated in the Hartree-Fock approximation. We present results for the number of electrons, magnetic moments, and density of states at the Fermi level. Good agreement with available experimental data is obtained. |
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