COHESIVE, STRUCTURAL, AND ELECTRONIC PROPERTIES OF FE-SI COMPOUNDS

作者: E. G. Moroni , W. Wolf , J. Hafner , R. Podloucky

DOI: 10.1103/PHYSREVB.59.12860

关键词: Lattice constantPseudopotentialLambdaAb initioBulk modulusMaterials scienceLattice (order)EpitaxyCondensed matter physicsMetal

摘要: … phases via high pressures or epitaxy. S0163-18299905419-3 … 9 the band structure of -FeSi2 in the vicinity of the band gap … of the gaps is increased by 0.04 eV, but they do not affect the …

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