Computational Materials Science · 2014 · 15 citations · 20 references
Natural SciencesMaterials SciencePhysicsCrystal StructureOptical MaterialsOpticsNonlinear Optical MaterialsOptical CeramicsOptical Properties Of MaterialsOptical Properties Of SolidsPerovskite MaterialsRefractive IndexCrystal Optical ConstantsCubic Equation Of StateNonlinear Optical PropertiesOptical PropertiesPressure DependenceThermo-optic Properties
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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
Self-Consistent Equations Including Exchange and Correlation Effects
W. Kohn, L. J. Sham · Physical Review · 1965 · 63.2K citations · Full text
WIEN2k: An Augmented Plane Wave Plus Local Orbitals Program for Calculating Crystal Properties
Peter Blaha, Karlheinz Schwarz, Georg K. H. Madsen et al. · 2019 · 3.4K citations
Natural Sciences, Chemistry, Physics +12
On the Theory of Dispersion of X-Rays
R. de L. Kronig · Journal of the Optical Society of America · 1926 · 1.9K citations