Publications
Publications at Clarkson University
2024
19. R. Stanton, W. Nei, S. Tretiak, and D. J. Trivedi, Data Mining and Computational Screening of Rashba-Dresselhaus Splitting and Optoelectronic Properties in Two-Dimensional Perovskite Materials, Submitted, (2024).18. R. Stanton and D. J. Trivedi, Two-Dimensional Double Perovskites in the Dion-Jacobson Phase Alleviate Parity Forbidden Transitions for Photovoltaic Applications, ACS Appl. Energy Mater., ASAP Article, Early Career Forum 2024, 2024.
17. S. Agrawal, D. Casanova, D. J. Trivedi, and O. V. Prezhdo, Enhanced Charge Separation in Single Atom Cobalt Based Graphitic Carbon Nitride: Time Domain Ab Initio Analysis, J. Phys. Chem. Lett., 15, 2202, 2024.
2023
16. R. Stanton and D. J. Trivedi, Charge Carrier Dynamics at the Interface of 2D Metal-Organic Framework and Hybrid Perovskites for Solar Energy Harvesting, Nano Lett., 23, 11932, 2023.15. R. Stanton and D. J. Trivedi, Pyrovskite: A software package for the high throughput construction, analysis, and featurization of two- and three-dimensional perovskite systems, J. Chem. Phys., 159, 064803, 2023.
14. H. Kolavada, D. J. Trivedi, P. N. Gajjar, and S. K. Gupta, Influence of Vacancy and Adsorption of Transition Metal on Performance of Single Layer of Boron Pnictides as a Supercapacitor Electrode: An Ab Initio Investigation, J Energy Storage, 72, 108444, 2023.
13. R. Stanton and D. J. Trivedi, Investigating the Increased CO2 Capture Performance of Amino Acid Functionalized Nanoporous Materials from First Principles and Grand Canonical Monte Carlo Simulations, J. Phys. Chem. Lett., 14, 5069, 2023.
12. N. P. Vu, L. Ali, T. L. Chua, D. A. Barr, H. P. Hendrickson and D. J. Trivedi, Computational Insights into Prostaglandin E2 Ligand Binding and Activation of G-Protein-Coupled Receptors, ACS Appl. Bio Mater., 7, 579, (Invited) 2024.
2022
11. R. Stanton and D. J. Trivedi, Atomistic Description of the Impact Spacer Selection has on 2D Perovskites: A Case Study of 2DRP CsPbI3 Analogs, J. Phys. Chem. Lett. (Journal Cover), 13, 12090, 2022.10. R. Stanton, E. Russell, and D. J. Trivedi, Computational Investigations of Metal-organic Frameworks as Sorbents for BTEX Removal, J. Phys. Chem. Lett., 13, 8150, 2022.
9. R. Stanton, S. Gupta, and D. J. Trivedi, Probing Strain-Induced Effects on Performance of Low-dimensional Hybrid Perovskites for Solar Energy Harvesting, ACS Appl. Mater. Interfaces, 14, 34603, 2022.
8. S. Agrawal, A. Vasenko, D. J. Trivedi, and O. V. Prezhdo, Charge carrier non-adiabatic dynamics in non-metal doped graphitic carbon nitride, J. Chem. Phys., 156, 094702, 2022.
2021
7. R. Stanton, E. Russell, H. Brandt, and D. J. Trivedi, Capture of Toxic Oxoanions from Water using Metal-Organic Frameworks, J. Phys. Chem. Lett. (Journal Cover), 12, 9175, 2021.6. R. Stanton and D. J. Trivedi, Influence of Defects and Linker Exchange on Removal of Phosphate using MOFs with Node Structure M6(OH)4(O)4 for M=Hf, Zr, Ce, Chem. Mater., 33, 5730, 2021.
5. R. Li, S. Alomari, R. Stanton, M. Wasson, T. Islamoglu, O. Farha, T. M. Holsen, S. Mededovic Thagard, D. Trivedi, M. Wriedt, Efficient Removal of Per- and Polyfluoroalkyl Substances from Water with Zirconium-based Metal-Organic Frameworks, Chem. Mater., 33, 3276, 2021.
2020
4. M. Hassan, R. Stanton, J. Secora, D. Trivedi, and S. Andreescu, Ultra-Fast Removal of Phosphate from Eutrophic Waters using Cerium-based Metal-Organic Framework, ACS Appl. Mater. Interfaces, 12, 52788, 2020.3. D. J. Trivedi, B. Barrow, and G. C. Schatz, Understanding the Chemical Contribution to the Enhancement Mechanism in SERS: Connection with Hammett Parameters, J. Chem. Phys. (Invited), 153, 124706, 2020.
2. S. Agrawal, W. Lin, O. V. Prezhdo, and D. J. Trivedi, Ab Initio Quantum Dynamics of Charge Carriers in Graphitic Carbon Nitride Nanosheets, J. Chem. Phys., 153, 054701, 2020.