The structural, elastic, optoelectronic properties and hydrogen storage capability of lead-free hydrides XZrH3 (X: Mg/Ca/Sr/Ba) for hydrogen storage application: A DFT study
M. Kashif Masood, Wahidullah Khan, Shumaila Bibi, Niqab Khan, Redi Kristian Pingak, Kamran Tahir, Javed Rehman, Aboud Ahmed Awadh Bahajjaj
Topics & Concepts
ChemistryHydrogen storageHydrogenLead (geology)Inorganic chemistryOrganic chemistryGeomorphologyGeologyHydrogen Storage and MaterialsNuclear Materials and PropertiesBoron and Carbon Nanomaterials Research