First-principles study for the hydrogen storage properties of XCrH3 (X = Na, K, and Sr) perovskite type hydrides
A. Azdad, A. Boutahar, M. Ballı, H. Lemziouka
Topics & Concepts
CASTEPHydrogen storageGravimetric analysisMaterials scienceDensity functional theoryPerovskite (structure)HydrideHydrogenIonic bondingMetalThermodynamicsPhysical chemistryBand gapThermogravimetric analysisIonic conductivityAbsorption (acoustics)Inorganic chemistryAbsorption spectroscopyAnalytical Chemistry (journal)ConductivityElectronic structureEnergy storageChemical physicsDebye modelHydrogen Storage and MaterialsThermal Expansion and Ionic ConductivityHeusler alloys: electronic and magnetic properties