Muhammad Imran

Adsorption and sensing properties of Janus MoSTe materials for characteristic gases (CO, C2H2, C2H4, CH4) in power transformers: A DFT study

Novel double hydride perovskites Li2TiF6-xHx as efficient materials for solid-state hydrogen storage: DFT insights

Probing direct bandgap of double perovskites Rb2LiTlX6 (X = Cl, Br) and optoelectronic characteristics for Solar cell applications: DFT calculations

Ab-initio prediction of the mechanical, magnetic and thermoelectric behaviour of perovskite oxides XGaO3 (X = Sc, Ti, Ag) using LDA+U functional: For optoelectronic devices