Engineering functional groups in UiO-66 metal-organic frameworks for hydrogen storage: A structure-property relationship investigation
Hao Wang, Wenqi Shi, Zhimeng Liu, Yuqiao Su, Tao Ban, Shaopeng Lu, Linmeng Wang, Zhe Yu, Hongyi Gao
Topics & Concepts
Hydrogen storageDensity functional theoryGravimetric analysisChemistryHydrogenFunctional groupAdsorptionBinding energyLigand (biochemistry)Computational chemistryNanotechnologyRational designChemical engineeringDipoleCombinatorial chemistryMaterials scienceElectronic structurePhysical chemistryChemical physicsElectronic effectMetal-Organic Frameworks: Synthesis and ApplicationsHydrogen Storage and MaterialsSupercapacitor Materials and Fabrication