Structural, optoelectronic, magnetic, elastic, thermodynamic and thermoelectric properties of NaVSi half-Heusler alloys
Sabir Makhlouf, Seif Eddine Amara, Abdelaziz Amara, M. Çakmak, Ceren Tayran, Hemza Kheribot, Ahmed Yasser Behlali
Abstract
Structural, electronic, magnetic, mechanical, optical, thermodynamic, and transport properties of half-Heusler alloys, this was achieved through density functional theory (DFT) calculations using the APW+lo method as implemented in the Wien2k code.
Topics & Concepts
Materials scienceThermoelectric effectCondensed matter physicsThermodynamicsPhysicsHeusler alloys: electronic and magnetic propertiesAdvanced Thermoelectric Materials and Devices2D Materials and Applications