Crystal chemistry and electronic structure of the β-AlFeSi phase from first-principles
Changming Fang, Z.P. Que, Z. Fan
Topics & Concepts
IntermetallicCrystal structureCrystal (programming language)Crystal chemistryPhase (matter)CrystallographyStackingDensity functional theoryAnisotropyElectronic structureHomogeneousChemical physicsMaterials scienceBand gapChemistryComputational chemistryThermodynamicsPhysicsComputer scienceMetallurgyOptoelectronicsAlloyProgramming languageQuantum mechanicsOrganic chemistryAluminum Alloy Microstructure PropertiesAluminum Alloys Composites PropertiesIntermetallics and Advanced Alloy Properties