Two-Dimensional CH3NH3PbI3 with High Efficiency and Superior Carrier Mobility: A Theoretical Study SR Kumavat, Y Sonvane, D Singh, SK Gupta The Journal of Physical Chemistry C 123 (9), 5231-5239, 2019 | 45 | 2019 |
Structural, optical, transport, and solar cell properties of 2D halide perovskite MAZX3 (Z= Pb, Sn, and X= Cl, Br, I) SR Kumavat, Y Sonvane, SK Gupta Journal of Applied Physics 128 (11), 2020 | 20 | 2020 |
Structural and compositional properties of 2D CH 3 NH 3 PbI 3 hybrid halide perovskite: a DFT study SR Kumavat, G Sachdeva, Y Sonvane, SK Gupta RSC advances 12 (40), 25924-25931, 2022 | 10 | 2022 |
Ab-initio study of strain engineering optical properties of RbPbI3 S Kumavat, D Singh, Y Sonvane, SK Gupta AIP Conference Proceedings 2115 (1), 2019 | 4 | 2019 |
Strain induced structural and electronic properties of BaReO3: A DFT study SR Kumavat, S Kansara, SK Gupta, Y Sonvane AIP Conference Proceedings 1942 (1), 2018 | 3 | 2018 |
Alkali metal doped nickel oxide clusters: A density functional study S Kumavat, M Deshpande Computational and Theoretical Chemistry 1035, 19-27, 2014 | 3 | 2014 |
Lead-free 2D MASnBr 3 and Ruddlesden–Popper BA 2 MASn 2 Br 7 as light harvesting materials SR Kumavat, Y Sonvane RSC advances 13 (12), 7939-7951, 2023 | 2 | 2023 |
Tuning the Electronic and Magnetic Properties of Fe3Se4 Material by Mechanical Strain SJ Yadav, J Jasani, SR Kumavat, D Singh, DV Shah, Y Sonvane, R Ahuja J. Mater. 4, 2668-5728, 2022 | 2 | 2022 |
Strain induced optical properties of BaReO3 SR Kumavat, S Kansara, SK Gupta, Y Sonvane AIP Conference Proceedings 1961 (1), 2018 | 2 | 2018 |
Adsorption mechanism of different toxic gases onto pristine BNC 2 and Al-doped BNC 2 monolayers P Chalase, S Deshpande, S Kumavat, M Deshpande Physical Chemistry Chemical Physics 25 (26), 17337-17351, 2023 | 1 | 2023 |
Structural stability and electronic properties of 2D MXene Hf3C2F2 monolayer by density functional theory approach RP Jadav, P Mishra, S Kumavat, D Singh, R Ahuja, Y Sonvane Biointerface Res. Appl. Chem. 13 (2), 152, 2022 | 1 | 2022 |
Lattice strain dependent optical properties of BaSnO3: First principle study S Kumavat, Y Sonvane, SK Gupta AIP Conference Proceedings 2265 (1), 2020 | 1 | 2020 |
Time dependent DFT investigation of the optical response in pristine and Gd doped Al 2 O 3 S Kumavat, S Chakraborty, AB Rahane, MD Deshpande, R Ahuja RSC advances 6 (76), 72537-72543, 2016 | 1 | 2016 |
Novel Hybrid Halide Perovskites Investigation of Potential Properties Using ab initio Approach SR Kumavat Surat, 0 | | |