[Publications]

 List of Publications [Book, Book chapters, Research Articles]

Books Chapters-

1. Advances in Highly Correlated Systems, Ravi Trivedi, Brahmananda Chakraborty, chapter for the book titled, “Strongly Correlated system of Materials: Modeling challenges and Exciting Phenomena, Edited by Parvathy Nancy, Wilfrid Prellier, Sabu Thomas, Nandakumar Kalarikkal, Publisher River, 2022, ISBN: 9788770224116

2. Fundamentals of Low Dimensional Magnets, Ravi Trivedi, Brahmananda Chakraborty, chapter for the book titled, “Design of Room temperature D0 Ferromagnetism for Spintronic application: Theoretical Perspectives, Edited by Jayachandran Rajendiran, Ram Gupta, Publisher Taylor & Francis, 2022 (ISBN: 9781003197492) DOI - https://doi.org/10.1201/9781003197492

3. Nanotechnology and Nanomaterials for Energy Ravi Trivedi, Brahmananda Chakraborty, chapter for the book titled, “Electrochemical energy storage in 2D nanomaterials; present status and future challanges, Edited by, Dr. Haghi, Neha Rawat, Publisher Taylor & Francis, 2022 (In press , To be Published)

4. 2D Materials-Based Electrochemical Sensors Samta Jain, Ravi Trivedi, Brahmananda Chakraborty, “An Introduction to two-dimensional materials (2DMs):Preparations and characterization, functionalization and device fabrication approaches for electrochemical sensors, ELSEVIER, 2022, (9780443152931

5. Sustainability in Energy and Environment: “Electrochemical Energy Storage in 2D Nanomaterials: Present Status and Future Challenges” Gopal Sanyal, Ravi Kumar Trivedi, and Brahmananda Chakraborty, Apple Academic Press, Taylor & Francis, 2023 (In press , To be Published)

Books

1.Ravi Kumar Trivedi, Debasish Bandyopadhyay, Hybrid Nanoclusters and Applications – A Density Functional Modeling, Lambert Academic Publisher, ISBN: 978-613-9-98674-3

1.   Ravi Trivedi, Brahmananda Chakraborty, Emerging Materials and Technologies series [Under Process – CRC press]

Published Research Articles –

1.Kempasiddaiah, Manjunatha; Samanta, Rajib; Trivedi, Ravi; Shrivastava, Dev; Chakraborty, Brahmananda; Barman, Sudip, Single-Crystalline α-Bi2O3Induced by Nitrogen-Doping for Enhanced and Selective CO2 Electroreduction to Formate over a Wide Negative Potential Window, ACS Applied Energy Materials, 2024, 7, 19, 8465–8477 https://doi.org/10.1021/acsaem.4c01358, IF = 6.4

2.      Sandip Kumar, Suren, Ravi Trivedi, Brahmananda Chakraborty, Combined effect of strain and intrinsic spin-orbit coupling on band gap engineering of
GNRs: A first-principles study, 2024 J. Phys.: Condens. Matter 36(48) 485401, 2024 https://doi.org/10.1088/1361-648X/ad743b IF = 2.3

3. Seetha lakshmy, Brinti, Trivedi Ravi, Nkkalarikkal, Nandini Garg, Brahmananda Chakraborty, Unveiling Novel Drug Delivery Mechanism : Cisplatin's Bonding Behaviour with BC4N Nanostructure, Physica Scripta, 2024, 99, 115001, DOI 10.1088/1402-4896/ad7dbe

4. Shashi pandey, aanchal sati, Ravi Trivedi, Vikash Mishra Uncovering Temperature-Induced Changes in Bandgap and Electronic Heterogeneity in Transition Metal Oxides through Optical Absorption Spectroscopy: A Review, Physica B: Condensed Matter, 695, 416485, 2024 IF = 2.7

5. Lingaraj Pradhan, Bishnupad Mohanty, Ganeswara Padhy, Ravi Kumar Trivedi, Debi Prasad Das, Brahmananda Chakraborty, Bikash Kumar Jena, Concerted Approach of Machine Learning and DFT in Finding the Supercapacitance Properties of Partially Oxidised-MXene Quantum Dots/Graphene Hybrids: Fabrication of Flexible/Wearable Micro-supercapacitor Devices, Chemical Engineering Journal, 154587, 2024, IF = 15.1 [https://doi.org/10.1016/j.cej.2024.154587]

6.Samanta, Rajib; Kempasiddaiah, Manjunatha; Trivedi, Ravi; Chakraborty, Brahmananda; Barman, Sudip. Sn/SnO2 Nanocomposite Encapsulated on Nitrogen Doped Carbon as a Highly Efficient Catalyst for Electrochemical Reduction of CO2 to Formate, ACS Applied Energy Materials , 2024 https://doi.org/10.1021/acsaem.4c00196

7.Biplab Kumar Manna, Rajib Samanta, Ravi Kumar Trivedi, Brahmananda Chakraborty,Sudip Barman Hydrogen Spillover Inspired Bifunctional Pt/Rh2O3- CNx Composite for Enhanced Hydrogen Evolution and Oxidation Reactions in Base [Journal of Colloid and Interface Science, 670(15), 258-271 2024 IF = 9.9]

8. Kempasiddaiah, M; Samanta, R; Panigrahi,S; Trivedi, R; Chakraborty, B; Barman, S. In-situ Electrochemically Reconstructed Copper-Cuprous Oxide Heterostructures on Carbon Cloth by 1D Cu(PyDC)(H2O) MOF and its N-doped CarbonComposites for Electrochemical CO2 Conversion [Accepted  – NanoScale, 2024 IF = 6.7]

9.Ravi Trivedi, Nandini Garg, Prafulla Jha, Brahmananda Chakraborty Probing the Structural, electronic and optical properties of pure and B, N, or Li substituted Cyclo-18 ring: Density Functional Theory Investigations. Physica Scripta, 2024, 99 055973, IF = 2.9

10. Lakshmy, Seetha; mane, pratap; Trivedi, Ravi; Kalarikkal, Nandakumar; Chakraborty, Brahmananda, Superior catechol sensing by Pd functionalized novel 2D Polyaramide: Insights from DFT simulations. Langmuir 2024, 40, 5, 2577–2590. IF =  4.33

11.Samanta, Rajib; Manna, Biplab; Trivedi, Ravi; Chakraborty, Brahmananda; Barman, Sudip Hydrogen Spillover Enhancing the Alkaline Hydrogen Electrocatalysis on Interface-Rich Metallic Pt-Supported MoO3, Chemical Science, 15, 364, 2024  IF = 9.9

12.Ravi Trivedi, Pritam Bhattacharya. A theoretical study of Ferrocene using combined configuration interaction single (CIS) and time-dependent density functional theory (TDDFT) approach. Physica Scripta, 2024, 99, 015929 Accepted IF = 2.9

13.Haque, A; Liu, Y; Karmakar, S; Fan, X; Trivedi, R; Chakraborty, B; Narayan, J Electrochemical Performance of Carbon-nanotube Supported Tubular Diamond. ACS Appl. Eng. Mater. 2023, 1, 8, 2153–2162 IF = 6.9

14.Sandeep K, Nikunj J, Ravi Trivedi, Cahnder S R, Brahmananda C. Recent development of two-dimensional tantalum dichalcogenides and their applications, Micro and Nanostructures, 181, 207627, 2023 IF=3.1

15.S Karmakar, P Sarkar, C Mistari, Ravi Trivedi, B Chakraborty, MA More. Tubular Diamond as an Efficient Electron Field Emitter, ACS Appl. Electron. Mater. 2023, 5, 7, 3592–3602, IF = 4.49

16.Ravi Trivedi Brinti Monda Nandini Garg Brahmananda Chakraborty, Novel Biphenyl as Cisplatin Anticancer Drug Delivery Carrier; Insight from theoretical perspective, Applied Surface Science, 2024, 645, 158837, IF = 7.39

17.Sreejith P.C., Seetha Lakshmya, Gopal Sanyal, Nandakumar Kalarikkala, Ravi Trivedi, and Brahmananda Chakraborty Metal Decorated γ-Graphyne as Drug transporting agent For Mercaptopurine chemotherapy drug: A DFT study, Phys. Chem. Chem. Phys., 2023, 25, 9461-9471 Accepted, DOI: 10.1039/D2CP05379A

18.Subrata Karmakar, Saif Taqy, Ravi Droopad, Ravi Kumar Trivedi, Brahmananda Chakraborty, and Ariful Haque, Highly Stable Electrochemical Supercapacitor Performance of Self-Assembled Ferromagnetic Q-carbon, ACS Appl. Mater. Interfaces 2023, 15, 6, 8305–8318

19.Ariful Haque*, Subrata Karmakar, Ravi Kumar Trivedi, Brahmananda Chakraborty, and Ravi Droopad Electric field emission mechanism in Q carbon field emitters, ACS Omega 2023, 8, 10, 9307–9318, https://doi.org/10.1021/acsomega.2c07576\

20.Ravi Trivedi, Surinder Kaur, Nandini Garg, Brahmananda Chakraborty Ti-decorated nitrogen-rich BeN4 monolayer for reversible hydrogen storage: DFT investigations, Applied Surface Science, 2023, 622, 156806

21.U Kiran, Choudhary B, Trivedi R, Brahmananda C, Chatterjee S, Besra L, Electric-field assisted ultrafast synthesis of Ti3SiC2 MAX phase, J Am Ceram Soc. 2022; 105: 7053– 7063. [DOI - https://doi.org/10.1111/jace.18684] IF =  4.18

22.Kundu, Trivedi R, Nandini G, Brahmananda C, Novel permeable material “yttrium decorated zeolite templated carbon” for hydrogen storage: Perspectives from density functional theory, International journal of Hydrogen energy, 2022,47,28573-28584 IF – 7.13

23.Debashis Bandyopadhyay, Soham, Ravi Trivedi, Kapil Dhaka Insight into catalytic behavior of TiMgn (n = 1-12) nanoclustersin hydrogen storage and dissociation process: A DFT investigation. International Journal of Hydrogen Energy, 2022, 47, 13418-13429, IF – 7.13

24.Ravi Trivedi, Debashis Bandyopadhyay. Study of adsorption and dissociation pathway of H2 molecule on Mg n Rh (n = 1-10) clusters: A first principle investigation. International journal of Hydrogen energy, 2016, 41, 20113-20121, IF – 7.13

25.Ravi Trivedi, Debashis Bandyopadhyay, Hydrogen storage in small size Mg n Co nanocluster- A density functional investigation, International journal of Hydrogen energy, 2015, 40, 12727- 12735 IF – 7.13

26.David Churchill, Jamelah S Al-Otaibi; Y.Sheena Mary; Y.Shyma Mary; Ravi Trivedi, Brahmananda Chakrabory. Theoretical SERS study of the strength and suitability of Cu12 Nnaocluster for SERS: Complete theoretical studies, coinage metal SM12 comparisons, Benzothiazole (BTH) adsorbent. Computational and Theoretical Chemistry, 2022, 1217, 113889

27.Jamelah S Al-Otaibi; Y.Sheena Mary; Y.Shyma Mary; Ravi Trivedi; Brahmananda Chakrabory; Renjith Thomas Cluster formation between an oxadiazole derivative with metal nanoclusters (Ag/Au/Cu), graphene quantum dot sheets, SERS studies and solvent effects [Structural Chemistry, 34, pages 867–877 (2023) https://doi.org/10.1007/s11224-022-02052-5]

28.Jamelah S. Al-OTAIBI, Y. shyma Mary, Ravi Trivedi, Brahmananda Chakraborty Rohitash Yadav, Molecular structure, vibrational spectra and electron localization function of biomolecules of phenothiazine derivatives and their interactions with Au and water  molecule: DFT investigations in search of effective drug for SARS-Cov-2, Journal of Biomolecular structure and Dynamics, 41:10, 4522-4533, 2022, , IF = 5.23

29.JS Al-Otaibi, YS Mary, YS Mary, M. Thiru, Ravi Trivedi, B Chakraborty ,Conformational, Reactivity Analysis, Wavefunction-Based Properties, Molecular Docking and Simulations of a Benzamide Derivative with Potential Antitumor Activity-DFT and MD Simulations, Polycyclic Aromatic Compounds, 43:3, 2015-2031, DOI: 10.1080/10406638.2022.2039229 IF – 3.74

30.Pawel Albrycht, Jamelah S. Al-OTAIBI, Y. shyma Mary, Ravi Trivedi, Brahmananda Chakraborty, Surface enhanced Raman scattering investigation of pioglitazone on silver and silver-gold metal substrates – Experimental analysis and theoretical modeling using DFT, Journal of Molecular Structure, 2022, 1244, 130992, IF – 3.84

31.JS Al-Otaibi, YS Mary, YS Mary, Ravi Trivedi, B Chakraborty, Theoretical investigation on the  adsorption of melamine in Al12/B12-N12/P12 fullerene-like nanocages: a platform for     ultrasensitive detection of melamine, Chemical Papers, 2021, 76, 225-238 IF – 2.09

32.Ravi Trivedi, Debashis Bandyopadhyay, Study of Electronic Structure and Stabilities of the small size EuGen (n=8-17) nanoclusters: An appraisal of (4n+2) Electronic aromaticity, [2022, J Mater Sci. 57, 19338-55]

33. Ravi Trivedi, PP Singh, Brahmananda Chakraborty Quantum Computational study of small Bismuth-Cobalt nanoalloy clusters, Optical & Quantum Electronics, 54(7), 1-16, 2022, IF  = 2.08

34. Ravi Trivedi, Debashis Bandyopadhyay, Study of Electronic Structure, Stabilities and Electron Localization Behavior of AgPbn (n=1-14) Nanoclusters: A First Principal Investigation, Physica E-Low Dimensional System and Nanostructures, 2021, 131, 114725 IF – 3.36

35.Ravi Trivedi, Vikash Mishra, 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, Journal of Molecular Structure, Oct - 2020, 1226, 129371 IF – 3.84

36. Ravi Trivedi, Debashis Bandyopadhyay, Insights of the role of shell closing model and NICS in the stability of NbGe n (n = 7-18) clusters: A first principle investigation. Journal of Material Science, 2018, 54, 515-528, IF – 4.22

37.Ravi Trivedi, Debashis Bandyopadhyay, Evolution of electronic and vibrational properties of M@X n (M= Ag, Au, X= Ge, Si, n= 10, 12, 14) clusters – A density functional modeling. Journal of Material Science, 2018, 53, 8263-8273, IF- 4.22

38. Ravi Trivedi, Kapil Dhaka, Debashis Bandyopadhyay, Study of electronic properties, stabilities and magnetic quenching of molybdenum-doped germanium clusters: A density functional investigation, RSC advance, 2014, 4, 64825, IF – 3.24