Pramana · 2023 · 23 citations · 32 references
Natural SciencesMaterials EngineeringMaterials ScienceComputational Materials ScienceCrystal StructureMetallurgyAb Initio MethodsAlloysComputational Solid MechanicsMetalsPhase DiagramsSolid Mechanics ApplicationsAlloy Phase DiagramsAlloyingHeusler AlloysHexagonal Crystal LatticesPhysical PropertiesZirconium Alloys
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Generalized Gradient Approximation Made Simple
John P. Perdew, Kieron Burke, Matthias Ernzerhof · Physical Review Letters · 1996 · 211.5K citations · Full text
Natural Sciences, Chemistry, Physics +16
First-principles simulation: ideas, illustrations and the CASTEP code
Matthew Segall, Philip J. D. Lindan, Matt Probert et al. · Journal of Physics Condensed Matter · 2002 · 11.8K citations · Full text