First-principles prediction of Mg decoration on monolayer g-C6N7 as a promising a hydrogen storage media
Ningning Zhang, Zhen‐Guo Fu, Xiaohui Wang, Xin-Peng Fu, Hong Yuan, Yong-Ting Shi, Ping Zhang, Ping Zhang
Topics & Concepts
MonolayerHydrogen storageGravimetric analysisAdsorptionChemistryMoleculeHydrogenAtom (system on chip)Density functional theoryBinding energyHydrogen atomPhysical chemistryComputational chemistryOrganic chemistryAtomic physicsPhysicsBiochemistryAlkylEmbedded systemComputer scienceHydrogen Storage and MaterialsBoron and Carbon Nanomaterials ResearchMXene and MAX Phase Materials