| Study of adsorption and dissociation pathway of H2 molecule on MgnRh (n= 1–10) clusters: A first principle investigation R Trivedi, D Bandyopadhyay international journal of hydrogen energy 41 (44), 20113-20121, 2016 | 64 | 2016 |
| Study of electronic properties, stabilities and magnetic quenching of molybdenum-doped germanium clusters: a density functional investigation R Trivedi, K Dhaka, D Bandyopadhyay RSC advances 4 (110), 64825-64834, 2014 | 64 | 2014 |
| Hydrogen storage in small size MgnCo clusters: a density functional study R Trivedi, D Bandyopadhyay international journal of hydrogen energy 40 (37), 12727-12735, 2015 | 46 | 2015 |
| Electronic structure and stabilities of Ni-doped germanium nanoclusters: a density functional modeling study K Dhaka, R Trivedi, D Bandyopadhyay Journal of molecular modeling 19, 1473-1488, 2013 | 34 | 2013 |
| Insights of the role of shell closing model and NICS in the stability of NbGen (n = 7–18) clusters: a first-principles investigation RK Triedi, D Bandyopadhyay Journal of materials science 54 (1), 515-528, 2019 | 28 | 2019 |
| Evolution of electronic and vibrational properties of M@ Xn (M= Ag, Au, X= Ge, Si, n= 10, 12, 14) clusters: a density functional modeling R Trivedi, D Bandyopadhyay Journal of materials science 53 (11), 8263-8273, 2018 | 26 | 2018 |
| Study of electronic structure, stabilities and electron localization behavior of AgPbn (n= 1–14) nanoclusters: A first principal investigation R Trivedi, A Banerjee, D Bandyopadhyay Physica E: Low-dimensional Systems and Nanostructures 131, 114725, 2021 | 20 | 2021 |
| Novel permeable material “Yttrium decorated Zeolite Templated Carbon” for Hydrogen storage: Perspectives from Density Functional Theory International Journal of Hydrogen Energy A Kundu, T Ravi, G Nandini, C Brahmananda International Journal of Hydrogen Energy 47 (66), 28573-28584, 2022 | 19 | 2022 |
| Surface enhanced Raman scattering investigation of pioglitazone on silver and silver-gold metal substrates–Experimental analysis and theoretical modeling P Albrycht, JS Al-Otaibi, YS Mary, YS Mary, R Trivedi, B Chakraborty Journal of Molecular Structure 1244, 130992, 2021 | 15 | 2021 |
| Insights into catalytic behavior of TiMgn (n=1-12) nanoclusters in hydrogen storage and dissociation process: A DFT investigation D Bandyopadhyay, S Chatterjee, R Trivedi, K Dhaka International Journal of Hydrogen Energy 47 (27), 13418-13429, 2022 | 14 | 2022 |
| Exploring the structural stability order and electronic properties of transition metal M@ Ge12 (M= Co, Pd, Tc, and Zr) doped germanium cage clusters–A density functional simulation R Trivedi, V Mishra Journal of Molecular Structure 1226, 129371, 2021 | 14 | 2021 |
| Highly Stable Electrochemical Supercapacitor Performance of Self-Assembled Ferromagnetic Q-carbon S KARMAKAR, S Taqy, R Droopad, R Trivedi, B Chakraborty, A Haque ACS Applied Materials & Interfaces 15 (6), 8305-8318, 2023 | 12 | 2023 |
| Theoretical investigation on the adsorption of melamine in Al12/B12-N12/P12 fullerene-like nanocages: a platform for ultrasensitive detection of melamine JS Al-Otaibi, YS Mary, YS Mary, R Trivedi, B Chakraborty Chemical Papers 76 (1), 225-238, 2022 | 12 | 2022 |
| Ti-decorated nitrogen-rich BeN4 monolayer for reversible hydrogen storage: DFT investigations R Trivedi, S Kaur, N Garg, B Chakraborty Applied Surface Science 622, 156806, 2023 | 10 | 2023 |
| Theoretical SERS study of the strength and suitability of Cu12 Nanostar for SERS: Complete theoretical studies, coinage metal SM12 comparisons, Benzothiazole (BTH) adsorbent D Churchill, JS Al-Otaibi, YS Mary, YS Mary, R Tridevi, B Chakraborty Computational & Theoretical Chemistry 1217, 113889, 2022 | 8 | 2022 |
| Cluster formation between an oxadiazole derivative with metal nanoclusters (Ag/Au/Cu), graphene quantum dot sheets, SERS studies and solvent effects JS Al-Otaibi, YS Mary, YS Mary, R Trivedi, B Chakrabory, R Thomas Struct Chem 34, 867-877, 2022 | 8 | 2022 |
| Insight into Stabilities and Magnetism of EuGen (n = 1-20) nanoclusters: An Assessment of Electronic Aromaticity R Trivedi, A Banerjee, D Bandyopadhyay Journal of Materials Sciecne 57, 19338-355, 2022 | 8 | 2022 |
| DFT and MD investigations of the biomolecules of phenothiazine derivatives: Interactions with gold and water molecules and investigations in search of effective drug for SARS-CoV-2 S Soman, Otaibi, Y. Sheena, Shyma, Ravi Trivedi, Brahmananda Chakraborty ... Journal of Biomolecule structure and Dynamics, 1-12, 2022 | 7* | 2022 |
| Metal Decorated γ-Graphyne as Drug transporting agent For Mercaptopurine chemotherapy drug: A DFT study SP Chandrasekharan, S Lakshmy, G Sanyal, N Kalarikkal, R Trivedi, ... Phys. Chem. Chem. Phys. 25, 9461-9471, 2023 | 5 | 2023 |
| Conformational, Reactivity Analysis, Wavefunction-Based Properties, Molecular Docking and Simulations of a Benzamide Derivative with Potential Antitumor Activity-DFT and MD … J, Y, Y, M, Ravi, B Chakraborty Polycyclic Aromatic Compound 43 (3), 2015-2031, 2023 | 5* | 2023 |
Dr. Brahmananda ChakrabortyBhabha Atomic Research CentreVerified email at barc.gov.in
