Physical Review B · 2015 · 1.5K citations · 37 references
Natural SciencesMaterials SciencePhysicsCondensed Matter PhysicsMaterials PhysicsSolid State PhysicsElectron-phonon InteractionsLattice DynamicsSelection RulesThermal Properties Of MaterialsLattice Thermal ConductivityLattice Thermal TransportLinearized Boltzmann EquationPhonon Density Of StatesPhonon DynamicsPhonon LifetimesPhonon-phonon InteractionsThermal Conductivity
A collaboration of researchers from Japan and France present a comprehensive study of phonon lifetimes and thermal conductivity for 33 zincblende- and wurtzite compounds using linearized phonon Boltzmann equation and first-principles anharmonic phonon calculations. The software that the authors created for this study will be released as an open source package and should be of help in the search of new materials for thermoelectric applications.
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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
Projector augmented-wave method
Peter E. Blöchl · Physical review. B, Condensed matter · 1994 · 90.8K citations
Natural Sciences, Chemistry, Physics +17