| Emergence of thermoelectricity in Half Heusler topological semimetals with strain K Kaur, S Dhiman, R Kumar Physics Letters A 381 (4), 339-343, 2017 | 54 | 2017 |
| Exploring thermoelectric properties and stability of half-Heusler PtXSn (X= Zr, Hf) semiconductors: a first principle investigation SA Khandy, K Kaur, S Dhiman, J Singh, V Kumar Computational Materials Science 188, 110232, 2021 | 41 | 2021 |
| Thermoelectric investigation of transition metal oxide NiO2: A first principles study AF Wani, B Rani, UB Sharopov, S Dhiman, K Kaur International Journal of Energy Research 46 (6), 8527-8535, 2022 | 29 | 2022 |
| Structural, electronic, mechanical, and thermoelectric properties of LiTiCoX (X= Si, Ge) compounds J Singh, K Kaur, SA Khandy, S Dhiman, M Goyal, SS Verma International Journal of Energy Research 45 (11), 16891-16900, 2021 | 27 | 2021 |
| A case study of Fe 2 TaZ (Z= Al, Ga, In) Heusler alloys: hunt for half-metallic behavior and thermoelectricity SA Khandy, I Islam, DC Gupta, MA Bhat, S Ahmad, TA Dar, S Rubab, ... RSC advances 8 (71), 40996-41002, 2018 | 27 | 2018 |
| SiH monolayer: A promising two‐dimensional thermoelectric material AF Wani, B Rani, S Dhiman, UB Sharopov, K Kaur International Journal of Energy Research 46 (8), 10885-10893, 2022 | 23 | 2022 |
| Enhanced pyroelectric figure of merits in Sr and Zr co-doped porous BaTiO3 ceramics M Aggarwal, M Kumar, R Syal, VP Singh, AK Singh, S Dhiman, S Kumar Journal of Materials Science: Materials in Electronics 31, 2337-2346, 2020 | 19 | 2020 |
| Electronic structure-, phonon spectrum-, and effective mass-related thermoelectric properties of PdXSn (X= Zr, Hf) Half Heuslers B Rani, AF Wani, UB Sharopov, L Patra, J Singh, AM Ali, ... Molecules 27 (19), 6567, 2022 | 18 | 2022 |
| Pursuit of stability, electronic and thermoelectric properties of novel PdVGa half heusler compound B Rani, AF Wani, SA Khandy, UB Sharopov, L Patra, K Kaur, S Dhiman Solid State Communications 351, 114796, 2022 | 16 | 2022 |
| Strain engineering on thermoelectric performance of Mg2Si SDRK Kulwinder Kaur Material Research Express 4, 075509, 2017 | 15 | 2017 |
| DFT study of Cu and Ag clusters inside C60 S Dhiman, R Kumar, K Dharamvir Journal of Molecular Structure 1100, 328-337, 2015 | 15 | 2015 |
| Computational prediction of thermoelectric properties of 2D materials K Kaur, SA Khandy, S Dhiman, UB Sharopov, J Singh Electronic Structure 4 (2), 023001, 2022 | 14 | 2022 |
| DFT investigations on the electronic structure, magnetism, thermodynamic and elastic properties of newly predicted cobalt based antiperovskites: Co3XN (X= Pd, Pt & Rh) SA Khandy, I Islam, K Kaur, A Laref, S Dhiman, S Rubab, DC Gupta, ... Results in Physics 17, 103112, 2020 | 14 | 2020 |
| Effect of Nd3+ substitution on structural, ferroelectric, magnetic and electrical properties of BiFeO3–PbTiO3 binary system N Kumar, B Narayan, M Kumar, AK Singh, S Dhiman, S Kumar SN Applied Sciences 1, 1-8, 2019 | 13 | 2019 |
| Anisotropic thermoelectric figure of merit in MoTe2 monolayer B Kaur, R Gupta, S Dhiman, K Kaur, C Bera Physica B: Condensed Matter 661, 414898, 2023 | 12 | 2023 |
| Substitutional doping of symmetrical small fullerene dimers S Kaur, A Sharma, H Sharma, S Dhiman, I Mudahar International Journal of Quantum Chemistry 119 (23), e26019, 2019 | 11 | 2019 |
| First-principles calculations on the electronic structure and thermoelectric properties of quaternary Heusler compounds: LiScPtSi and LiScPdGe J Singh, K Kaur, MA Bhat, UB Sharopov, S Dhiman, M Goyal, SS Verma, ... Materials Today Communications 32, 103961, 2022 | 9 | 2022 |
| Magnetoelectric coupling susceptibility in novel lead-free 0–3 type multiferroic particulate composites of (1-x) Na0. 5Bi0. 5TiO3-(x) CoCr0. 4Fe1. 6O4 R Goel, R Syal, G Sharma, RK Singh, S Dhiman, AK Singh, S Kumar Materials Chemistry and Physics 282, 126004, 2022 | 9 | 2022 |
| Enhanced room temperature multiferroic behaviour of Ni-doped Na0.5Bi0.5TiO3 ceramics R Goel, R Syal, N Sharma, S Dhiman, AK Singh, A Garg, S Kumar Journal of Materials Science: Materials in Electronics 32, 10255-10265, 2021 | 9 | 2021 |
| First principles calculations to investigate Li-based quaternary Heusler compounds LiHfCoX (X= Ge, Sn) for thermoelectric applications T Kaur, J Singh, M Goyal, K Kaur, SA Khandy, MA Bhat, UB Sharopov, ... Physica Scripta 97 (10), 105706, 2022 | 8 | 2022 |
