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- W2094961314 abstract "The LMTO method has been used for band calculations on V3Si, V3Ge, V3Ga, Cr3Si and Cr3Ge. Within the unhybridised, canonical scheme of Andersen (1973, 1975) which has been extended to the case of several atoms per unit cell, self-consistent potentials have been obtained and subsequently used in LMTO calculations. Gross features of the density of states seem to be well described, and the agreement with XPS, SXE and X-ray diffraction measurements is very satisfactory. A correct treatment of the Madelung contribution to the potential is found to be essential for the self-consistency procedure." @default.
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- W2094961314 date "1977-09-01" @default.
- W2094961314 modified "2023-10-01" @default.
- W2094961314 title "The electronic structure of some A15 compounds by semiself-consistent band calculations" @default.
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- W2094961314 doi "https://doi.org/10.1088/0305-4608/7/9/009" @default.
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