Journal Papers:

Sr #	Description
1	Tuning of Band Gap by Anion Variation of Double Perovskites K2AgInX6 (X = Cl, Br) for Solar Cells and Thermoelectric Applications, J. Solid State Chemistry, (2022). DOI:10.1016/j.jssc.2022.123820
2	Study of Ferromagnetism and Thermoelectric Behaviour of Thiospinels MgFe2(S/Se)4 for Spintronics and Energy Harvesting, Physica Scripta, (2022). DOI:10.1088/1402-4896/ac96d7
3	Tuning of Band Gap by Anion Variation of Ga2TiX6 (X = Cl, Br, I) for Solar Cells and Renewable Energy, Physica Scripta, (2022). DOI: 10.1088/1402-4896/ac7efc
4	Quantum Ferromagnetism in Transition Metals Doped II-VI Semiconductors for Spintronic Applications: A Merging Technology, Solid State Communications, (2022). DOI: 10.1016/j.ssc.2022.114835
5	An Ab-initio Study of Electronic and Optical Properties of RhXO3 (X = Ga, Ag) Perovskites, Physica Scripta, (2022). DOI: 10.1088/1402-4896/ac4b34
6	First-Principles Study of Lead-Free Double Perovskites Ga2PdX6 (X = Cl, Br, and I) for Solar Cells and Renewable Energy, Journal of Materials Research and Technology, (2021). DOI: 10.1016/j.jmrt.2021.12.002
7	First Principle Analysis of Lead-free Variant Perovskites Iodides for Optical and Thermoelectric Applications, Journal of Material Research and Technology, (2021). DOI:10.1016/j.jmrt.2021.09.154
8	First-principle Study of Electronic, Optical and Transport Properties for (Zn/Cd)Sc2Se4 spinel chalcogenides, Bulletin of Materials Science, (2021). DOI: 10.1007/s12034-021-02544-w
9	Hydrothermal Synthesis, Characterization and Photocatalytic Activity of Mg doped MoS2” Zeitschrift für Physikalische Chemie, (2021). DOI: 10.1515/zpch-2020-1635
10	Synthesis of WO3 Nanosheet and its Application in CdTe Thin Film Solar Cells” Journal of Alloys and Compounds, (2021). DOI: 10.1016/j.jallcom.2021.161367
11	New lead-free double perovskites (Rb2GeCl/Br)6; a promising materials for renewable energy applications, Materials Chemistry and Physics (2021). DOI: 10.1016/j.matchemphys.2021.124876
12	A density functional theory study of the structural, electronic, and optical properties of XGaO3 (X = V, Nb) perovskites for optoelectronic applications, Journal of Computational Electronics (2021), DOI: 10.1007/s10825-021-01718-3
13	Preparation and application of LiSiC-oxide for low temperature solid oxide fuel cells, Digest Journal of Nanomaterials and Biostructures (2021).
14	First Principle Analysis of Electronic, Optical and Thermoelectric Characteristics of XBiO3 (X = Al, Ga, In) Perovskites, Opto-electronics Review (2020), DOI: 10.24425/opelre.2020.132497
15	Tailoring of Bandgap to Tune the Optical Properties of Ga1−xAlxY (Y = As, Sb) for Solar Cell Applications by Density Functional Theory Approach (2019), DOI: 10.1515/zna-2019-0176
16	1H Chemical Shifts in Paramagnetic Co(II) Pyrazolylborate Complexes: A First-Principles Study, DOI: 10.1021/acs.jctc.5b00193
17	Magnetic Couplings in the Chemical Shift of Paramagnetic NMR, DOI: 10.1021/acs.jctc.5b00656
18	Paramagnetic Enhancement of Nuclear Spin-Spin Coupling, DOI: 10.1021/acs.jctc.6b01080
19	Relativistic Approximations to Paramagnetic NMR Chemical Shift and Shielding Anisotropy in Transition Metal Systems, DOI: 10.1021/acs.jctc.7b00168
20	Assignment of solid-state 13 C and 1 H NMR spectra of paramagnetic Ni(II) acetylacetonate complexes aided by first-principles computations, DOI: 10.1016/j.ssnmr.2017.07.003