Ab initio study of the mechanical properties and thermal conductivity of Bi2O2X (X = Se, Te) under pressure
Yi X. Wang, Zheng Yan, Wei Liu, Gao L. Zhou, Jian Gu
Topics & Concepts
Materials scienceAnisotropyBulk modulusThermodynamicsThermal conductivityDuctility (Earth science)Shear modulusLattice constantElastic modulusThermoelectric effectAb initioDensity functional theoryCondensed matter physicsComposite materialChemistryComputational chemistryOpticsCreepPhysicsDiffractionOrganic chemistryAdvanced Thermoelectric Materials and DevicesThermal properties of materialsHeusler alloys: electronic and magnetic properties