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Thermal conductivity calculation based on Green–Kubo formula using ANN potential for β-Ag2Se

Yusuke Takeshita, Kohei Shimamura, Shogo Fukushima, Akihide Koura, Fuyuki Shimojo

2022Journal of Physics and Chemistry of Solids23 citationsDOI

Topics & Concepts

Molecular dynamicsInteratomic potentialThermal conductivityArtificial neural networkStatistical physicsLattice (music)ThermodynamicsComputer scienceMaterials sciencePhysicsChemistryComputational chemistryMachine learningAcousticsMachine Learning in Materials ScienceAdvanced Thermoelectric Materials and DevicesPhase-change materials and chalcogenides
Thermal conductivity calculation based on Green–Kubo formula using ANN potential for β-Ag2Se | Litcius