First-principles investigation for the hydrogen storage properties of XTiH3 (X=K, Rb, Cs) perovskite type hydrides
Nanlin Xu, Yan Chen, Shanjun Chen, Li Song, Weibin Zhang
Topics & Concepts
Hydrogen storageHydrideHydrogenGravimetric analysisThermodynamicsPerovskite (structure)MetalDesorptionChemistryDensity functional theoryEnthalpyPhysical chemistryMaterials scienceComputational chemistryCrystallographyOrganic chemistryPhysicsAdsorptionHydrogen Storage and MaterialsAdvanced Battery Materials and TechnologiesMXene and MAX Phase Materials