Research outputs
2025
Strongly Correlated Electronic Structure of Some Graphene Nano Ribbons and Nano Flakes
Prodhan, S., & Ramasesha, S. (2025). Strongly Correlated Electronic Structure of Some Graphene Nano Ribbons and Nano Flakes. JOURNAL OF COMPUTATIONAL CHEMISTRY, 46(23). doi:10.1002/jcc.70216
2024
Effective Model Reduction Scheme for the Electronic Structure of Highly Doped Semiconducting Polymers
Prodhan, S., & Troisi, A. (2024). Effective Model Reduction Scheme for the Electronic Structure of Highly Doped Semiconducting Polymers. JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 20(22), 10147-10157. doi:10.1021/acs.jctc.4c01131
Spin relaxation of electron and hole polarons in ambipolar conjugated polymers.
Carey, R. L., Giannini, S., Schott, S., Lemaur, V., Xiao, M., Prodhan, S., . . . Sirringhaus, H. (2024). Spin relaxation of electron and hole polarons in ambipolar conjugated polymers.. Nature communications, 15(1), 288. doi:10.1038/s41467-023-43505-7
2023
From monomer sequence to charge mobility in semiconductor polymers via model reduction
Prodhan, S., Manurung, R., & Troisi, A. (2023). From monomer sequence to charge mobility in semiconductor polymers via model reduction. Advanced Functional Materials.
From monomer sequence to charge mobility in semiconductor polymers via model reduction
2022
Thermally activated intra-chain charge transport in high charge-carrier mobility copolymers
Dilmurat, R., Prodhan, S., Wang, L., & Beljonne, D. (2022). Thermally activated intra-chain charge transport in high charge-carrier mobility copolymers. JOURNAL OF CHEMICAL PHYSICS, 156(8). doi:10.1063/5.0082569
Long-Range Interactions Boost Singlet Exciton Diffusion in Nanofibers of pi-Extended Polymer Chains (vol 12, pg 8188, 2021)
Prodhan, S., Giannini, S., Wang, L., & Beljonne, D. (2022). Long-Range Interactions Boost Singlet Exciton Diffusion in Nanofibers of pi-Extended Polymer Chains (vol 12, pg 8188, 2021). JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 13(4), 1002. doi:10.1021/acs.jpclett.2c00127
2021
Long-Range Interactions Boost Singlet Exciton Diffusion in Nanofibers of π-Extended Polymer Chains
Prodhan, S., Giannini, S., Wang, L., & Beljonne, D. (2021). Long-Range Interactions Boost Singlet Exciton Diffusion in Nanofibers of π-Extended Polymer Chains. JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 12(34), 8188-8193. doi:10.1021/acs.jpclett.1c02275
Efficient energy transport in an organic semiconductor mediated by transient exciton delocalisation
Sneyd, A., Fukui, T., Paleček, D., Prodhan, S., Wagner, I., Zhang, Y., . . . Rao, A. (2021). Efficient energy transport in an organic semiconductor mediated by transient exciton delocalisation. In D. Congreve, C. Nielsen, A. J. Musser, & D. Baran (Eds.), Physical Chemistry of Semiconductor Materials and Interfaces XX (pp. 9). SPIE. doi:10.1117/12.2594688
Efficient energy transport in an organic semiconductor mediated by transient exciton delocalization
Sneyd, A. J., Fukui, T., Palecek, D., Prodhan, S., Wagner, I., Zhang, Y., . . . Rao, A. (2021). Efficient energy transport in an organic semiconductor mediated by transient exciton delocalization. SCIENCE ADVANCES, 7(32). doi:10.1126/sciadv.abh4232
Long-range interactions boost singlet exciton diffusion in nanofibers of $\pi$-extended polymer chains
Long-range interactions boost singlet exciton diffusion in nanofibers of $\pi$-extended polymer chains
Long-Range Electrostatics Supercharge Exciton Transport
Sneyd, A., Fukui, T., Beljonne, D., Manners, I., Friend, R., Rao, A., & Prodhan, S. (2021). Long-Range Electrostatics Supercharge Exciton Transport. In Proceedings of the 13th Conference on Hybrid and Organic Photovoltaics. Fundació Scito. doi:10.29363/nanoge.hopv.2021.046
2020
Design Rules to Maximize Charge-Carrier Mobility along Conjugated Polymer Chains
Prodhan, S., Qiu, J., Ricci, M., Roscioni, O. M., Wang, L., & Beljonne, D. (2020). Design Rules to Maximize Charge-Carrier Mobility along Conjugated Polymer Chains. JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 11(16), 6519-6525. doi:10.1021/acs.jpclett.0c01793
2019
Correlated Electronic Properties of a Graphene Nanoflake: Coronene
Prodhan, S., Mazumdar, S., & Ramasesha, S. (2019). Correlated Electronic Properties of a Graphene Nanoflake: Coronene. MOLECULES, 24(4). doi:10.3390/molecules24040730
2018
A Model Exact Study of the Properties of Low-Lying Electronic States of Perylene and Substituted Perylenes
Giri, G., Prodhan, S., Pati, Y. A., & Ramasesha, S. (2018). A Model Exact Study of the Properties of Low-Lying Electronic States of Perylene and Substituted Perylenes. JOURNAL OF PHYSICAL CHEMISTRY A, 122(43), 8650-8658. doi:10.1021/acs.jpca.8b08656
Symmetrized density matrix renormalization group algorithm for low-lying excited states of conjugated carbon systems: Application to 1,12-benzoperylene and polychrysene
Prodhan, S., & Ramasesha, S. (2018). Symmetrized density matrix renormalization group algorithm for low-lying excited states of conjugated carbon systems: Application to 1,12-benzoperylene and polychrysene. PHYSICAL REVIEW B, 97(19). doi:10.1103/PhysRevB.97.195125
2017
Exact wave packet dynamics of singlet fission in unsubstituted and substituted polyene chains within long-range interacting models
Prodhan, S., & Ramasesha, S. (2017). Exact wave packet dynamics of singlet fission in unsubstituted and substituted polyene chains within long-range interacting models. PHYSICAL REVIEW B, 96(7). doi:10.1103/PhysRevB.96.075142
2016
Correlated electronic properties of some graphene nanoribbons: A DMRG study
Goli, V. M. L. D. P., Prodhan, S., Mazumdar, S., & Ramasesha, S. (2016). Correlated electronic properties of some graphene nanoribbons: A DMRG study. PHYSICAL REVIEW B, 94(3). doi:10.1103/PhysRevB.94.035139
2014
Model for triplet state engineering in organic light emitting diodes
Prodhan, S., Soos, Z. G., & Ramasesha, S. (2014). Model for triplet state engineering in organic light emitting diodes. JOURNAL OF CHEMICAL PHYSICS, 140(21). doi:10.1063/1.4880276