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First-principles calculations to investigate structural, electronic, magnetic, mechanical and thermodynamic properties of Half-Heusler alloy CoMnTe: Using GGA and GGA+U methods

Y. Toual, S. Mouchou, A. Azouaoui, A. Harbi, M. Moutaabbid, A. Hourmatallah, K. Bouslykhane, N. Benzakour

2023Materials Chemistry and Physics27 citationsDOI

Topics & Concepts

Condensed matter physicsTetragonal crystal systemMaterials scienceDensity functional theoryFerromagnetismMagnetic momentElectronic structureSpin polarizationHeusler compoundMagnetismElectronic band structureHalf-metalAtom (system on chip)Phase (matter)SpintronicsComputational chemistryChemistryPhysicsElectronComputer scienceQuantum mechanicsOrganic chemistryEmbedded systemHeusler alloys: electronic and magnetic propertiesAdvanced Thermoelectric Materials and DevicesMXene and MAX Phase Materials
First-principles calculations to investigate structural, electronic, magnetic, mechanical and thermodynamic properties of Half-Heusler alloy CoMnTe: Using GGA and GGA+U methods | Litcius