दीनदयाल उपाध्याय गोरखपुर विश्वविद्यालय
Deen Dayal Upadhyaya Gorakhpur University
(Accredited A++ by NAAC)
Dr. Madan Singh Chauhan
Ph.D., Assistant Professor
Department of Physics
Gyrotron Devices and Molecular Dynamics
| S.No. | Employer | Designation | From | To |
|---|---|---|---|---|
| 1 | IIT Roorkee | NPDF | 27.03.2017 | 06.07.2018 |
| S.No. | Title | Journal | Volume | Year | Contribution |
|---|---|---|---|---|---|
| 1 | In silico study of inhibition activity of boceprevir drug against 2019-nCoV main protease | Zeitschrift für Naturforschung C | NA | 2024 | Co-author |
| 2 | Ab-initio, Molecular Docking and MD Simulation of an Anti-HIV Drug (Lamivudine): An In-silico Approach | Biomedical Materials & Devices | NA | 2023 | Co-author |
| 3 | First principles study of nonlinear optical, electronic properties and absorption spectra of some anti-HIV drugs: a comparative approach | Optical and Quantum Electronics | 55 | 2023 | Co-author |
| 4 | Influence of electric field on the electro-optical and electronic properties of 4-n-alkoxy-4 -cyanobiphenyl liquid crystal series: An application of DFT | Pramana | 97 | 2023 | Co-author |
| 5 | Electro-Optical Properties of MBBA Liquid Crystal Surrounded by Acetonitrile Medium Enhanced under the Presence of Electric Field: An Ab Initio Study | Macromolecular Symposia | 407 | 2023 | Co-author |
| 6 | Theoretical study of highly efficient all-inorganic Sb2S3-on-Si monolithically integrated (2-T) and mechanically stacked (4-T) tandem solar cells using SCAPS-1D | Environmental Science and Pollution Research | 30 | 2023 | Co-author |
| 7 | MAPbI3-on-CuInSe2 two-terminal monolithically integrated and four-terminal mechanically stacked tandem solar cells: A Theoretical Investigation Using SCAPS-1D | Results in Optics | 10 | 2023 | Co-author |
| 8 | Ab-initio and molecular dynamics simulation of a discotic liquid crystal in ionic solution | Molecular Simulation | 49 | 2023 | Co-author |
| 9 | Systematic in silico studies of corticosteroids and its binding affinities with glucocorticoid receptor for Covid-19 treatment: Ab-initio, molecular docking and MD simulation studies | Polycyclic Aromatic Compounds | 43 | 2023 | Co-author |
| 10 | Performance analysis of n-TiO2/p-Cu2O, n-TiO2/p-WS2/p-Cu2O, and n-TiO2/p-WS2 heterojunction solar cells through numerical modelling | Environmental Science and Pollution Research | 30 | 2022 | Co-author |
| 11 | Fluorination of 2,5-diphenyl-1,3,4-oxadiazole enhances the electron transport properties for OLED devices: a DFT analysis | Phase Transitions | 95 | 2022 | Co-author |
| 12 | Numerical investigation of silicon heterojunction solar cell with zinc selenide as electron-selective and nickel oxide as hole-selective contacts | Optical Materials | 127 | 2022 | Co-author |
| S.No. | Name | Contact Details Year of Enrollment |
Type of Scholar | Topic | Research Status |
|---|---|---|---|---|---|
| 1 | Nazish Fatima Siddiqui | 9452436642 nazishfatima.nfs@gmail.com |
Research Scholar | Studies on Millimeter Wave Gyroklystron Amplifiers | Ongoing |