An ab initio study on semiconducting half Heusler alloys TiAgZ (Z=Al, Ga, In) for thermoelectric and optoelectronic applications
S S Beenaben, Radha Sankararajan, Srinivasan Manickam, K. Klinton Brito
Topics & Concepts
Materials scienceThermoelectric effectAb initioOptoelectronicsCondensed matter physicsThermoelectric materialsAb initio quantum chemistry methodsEngineering physicsThermodynamicsComposite materialQuantum mechanicsThermal conductivityEngineeringPhysicsMoleculeHeusler alloys: electronic and magnetic propertiesAdvanced Thermoelectric Materials and DevicesMXene and MAX Phase Materials