An ab-initio study of the physical properties of Ge-based perovskites (XGeH3: X=Mg, Ca, and Sr) for potential hydrogen storage application
M. Kashif Masood, Ghulam Murtaza, Nadia Ahmad, Nadia Ahmad, Maryam Touqir, Iram Hafiz, Ahmad Usman, Ahmad Ayyaz, Nazir Ahmad, Nazir Ahmad
Topics & Concepts
Hydrogen storageAb initioHydrogenMaterials scienceAb initio quantum chemistry methodsPhysical chemistryComputational chemistryThermodynamicsChemistryPhysicsMoleculeOrganic chemistryHydrogen Storage and MaterialsThermal Expansion and Ionic ConductivityAdvanced Battery Materials and Technologies