The thermoelectric properties of novel two-dimensional semiconductor ZrNBr alloyed with Fluorine: A DFT+U survey
Fatemeh Shirvani, Zahra Razavifar
Topics & Concepts
Seebeck coefficientThermoelectric effectElectrical resistivity and conductivityThermoelectric materialsDensity of statesDensity functional theoryCondensed matter physicsBand gapMaterials scienceThermal conductivityHubbard modelChemistryThermodynamicsComputational chemistryPhysicsQuantum mechanicsSuperconductivityComposite materialMXene and MAX Phase Materials2D Materials and ApplicationsAdvanced Thermoelectric Materials and Devices