Theoretical DFT insights into the stability, electronic, mechanical, optical, thermodynamic, and hydrogen storage properties of RbXH3 (X = Si, Ge, Sn) Perovskite Hydrides
Marouane Archi, Omar Bajjou, Khalid Rahmani, Benachir Elhadadi
Topics & Concepts
Hydrogen storagePerovskite (structure)Materials scienceChemical stabilityHydrogenStability (learning theory)ThermodynamicsDensity functional theoryPhysical chemistryCrystallographyComputational chemistryMetallurgyChemistryPhysicsComputer scienceAlloyOrganic chemistryMachine learningHydrogen Storage and MaterialsThermal Expansion and Ionic ConductivityAdvanced Battery Materials and Technologies