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Publications (35)
- A DFT Study on the Structural, Electronic, Optical, and Mechanical Properties of Lead-Free Perovskites $$\hbox {Rb}_2$$ $$\hbox {YAuX}_6$$ (X = F, Cl, Br, I) for Solar Cell Applications Save
- Visible-light-driven photocatalytic water splitting in double perovskite halides Cs2 TlInX6 (X = Cl, Br, I): a first-principles study Save
- Structural, electronic, optical, mechanical and piezoelectric properties of AIO3 (A = Na, K, and Rb) for energy harvesting materials: an ab initio approach Save
- Unveiling the optical and piezoelectric properties of organic–inorganic hybrid perovskites FAPbX3 (X = Cl, Br, I): a DFT study Save
- The effect of on-site and inter-site Hubbard correction in the thermoelectric properties of quaternary Heusler alloys NaHfXSn (X = Co, Rh, Ir): a first-principles study Save
- Structural phase transition, electronic and mechanical properties of NaVO3: a density functional theory study Save
- Group-I lead oxide X 2 PbO 3 (X = Li, Na, K, Rb, and Cs) glass-like materials for energy applications: a hybrid-DFT study Save
- Exploring the functional properties of the diamond-like quaternary compound Li 2 ZnGeS 4 for potential energy applications: a theoretical approach Save
- A comprehensive study of electronic, optical, mechanical and piezoelectric properties of Li-based tin-halide perovskites using GGA, meta-GGA and HSE06 methods Save
- Pressure-sensitive germanate glass-Li 2 GeO 3 , a multifunctional energy material: a theoretical study Save