Developing the insight for systematic exploration of hydrogen storage in RbMgF3
Muhammad Shahzad, Hamza Naeem, Muhammad Waseem Yasin, Zahid Usman, S.S. Ali, Muhammad Rizwan
Topics & Concepts
Hydrogen storageCASTEPHydrogenDensity functional theoryTetragonal crystal systemMaterials scienceBand gapEnthalpyFermi levelCrystal structureOptoelectronicsCrystallographyChemistryComputational chemistryThermodynamicsOrganic chemistryPhysicsElectronQuantum mechanicsThermal Expansion and Ionic ConductivityMXene and MAX Phase MaterialsHeusler alloys: electronic and magnetic properties