Journal of Alloys and Compounds · 2018 · 31 citations · 36 references
Natural SciencesMaterials SciencePhysicsComputational Materials ScienceCondensed Matter PhysicsMaterials PhysicsAb Initio MethodsDensity Functional TheoryMaterial ModelingOrder-disorder ThermodynamicsSize-dependent PropertiesThermodynamics Of NanomaterialsChemical OrderingDisorder TransitionsOrder TransitionsOrdering EnergeticsSolid-state Property Optimization
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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
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Introduction to Solid State Physics
C. Kittel, Heng Fan · American Journal of Physics · 1957 · 22.4K citations
Separable dual-space Gaussian pseudopotentials
Stefan Goedecker, M. P. Teter, Jürg Hutter · Physical review. B, Condensed matter · 1996 · 7.4K citations · Full text
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