Dr Anjay Manian | ARC Centre of Excellence in Exciton Science

Dr Anjay Manian

Research Assistant

Centre Research Themes: 
2. Control of Excitons

Publications

Journal Articles
Manian, A.; Hudson, R. J.; Ramkissoon, P.; Smith, T. A.; Russo, S. P. Interexcited State Photophysics I: Benchmarking Density Functionals for Computing Nonadiabatic Couplings and Internal Conversion Rate Constants. Journal of Chemical Theory and Computation 2023, 19 (1), 271-292 DOI: 10.1021/acs.jctc.2c00888. doi: 10.1021/acs.jctc.2c00888
Pervin, R.; Manian, A.; Chen, Z.; Christofferson, A. J.; Owyong, T. Cin; Bradley, S. J.; White, J. M.; Ghiggino, K. P.; Russo, S. P.; Wong, W. W. H. Medium effects on the fluorescence of Imide-substituted naphthalene diimides. Journal of Photochemistry and Photobiology A: Chemistry 2023, 436, 114364 DOI: 10.1016/j.jphotochem.2022.114364. doi: 10.1016/j.jphotochem.2022.114364
Fenati, R. A.; Chen, Z.; Yamagishi, Y.; Tsukakoshi, K.; Ikebukuor, K.; Manian, A.; Russo, S. P.; Yamazaki, T.; Ellis, A. V. Enhancement of DNAzymatic activity using iterative in silico maturation. Journal of Materials Chemistry B 2022, 10 (43), 8960 - 8969 DOI: 10.1039/D2TB01638A. doi: 10.1039/D2TB01638A
Manian, A.; Lyskov, I.; Shaw, R. A.; Russo, S. P. A first principles examination of phosphorescence. RSC Advances 2022, 12 (39), 25440 - 25448 DOI: 10.1039/D2RA03447F. doi: 10.1039/D2RA03447F
Manian, A.; Shaw, R. A.; Lyskov, I.; Russo, S. P. Exciton Dynamics of a Diketo-Pyrrolopyrrole Core for All Low-Lying Electronic Excited States Using Density Functional Theory-Based Methods. Journal of Chemical Theory and Computation 2022, 18 (3), 1838 - 1848 DOI: 10.1021/acs.jctc.2c00070. doi: 10.1021/acs.jctc.2c00070
Manian, A.; Russo, S. P. The dominant nature of Herzberg–Teller terms in the photophysical description of naphthalene compared to anthracene and tetracene. Scientific Reports 2022, 12 (1), 21481 DOI: 10.1038/s41598-022-24081-0. doi: 10.1038/s41598-022-24081-0
Manian, A.; Shaw, R. A.; Lyskov, I.; Russo, S. P. The quantum chemical solvation of indole: accounting for strong solute–solvent interactions using implicit/explicit models. Physical Chemistry Chemical Physics 2022, 24 (5), 3357-3369 DOI: 10.1039/D1CP05496A. doi: 10.1039/D1CP05496A
Manian, A.; Campaioli, F.; Lyskov, I.; Cole, J. H.; Russo, S. P. Singlet Exciton Dynamics of Perylene Diimide- and Tetracene-Based Hetero/Homogeneous Substrates via an Ab Initio Kinetic Monte Carlo Model. The Journal of Physical Chemistry C 2021, 125 (43), 23646-23656 DOI: 10.1021/acs.jpcc.1c07929. doi: 10.1021/acs.jpcc.1c07929
Shaw, R. A.; Manian, A.; Lyskov, I.; Russo, S. P. Efficient enumeration of bosonic configurations with applications to the calculation of non-radiative rates. The Journal of Chemical Physics 2021, 154 (8), 084102 DOI: 10.1063/5.0039532. doi: 10.1063/5.0039532
Manian, A.; Shaw, R. A.; Lyskov, I.; Wong, W. W. H.; Russo, S. P. Modeling radiative and non-radiative pathways at both the Franck–Condon and Herzberg–Teller approximation level. The Journal of Chemical Physics 2021, 155 (5), 054108 DOI: 10.1063/5.0058643. doi: 10.1063/5.0058643
Meftahi, N.; Manian, A.; Christofferson, A. J.; Lyskov, I.; Russo, S. P. A computational exploration of aggregation-induced excitonic quenching mechanisms for perylene diimide chromophores. The Journal of Chemical Physics 2020, 153 (6), 064108 DOI: 10.1063/5.0013634. doi: 10.1063/5.0013634
Zhang, B.; Lyskov, I.; Wilson, L. J.; Sabatini, R. P.; Manian, A.; Soleimaninejad, H.; White, J. M.; Smith, T. A.; Lakhwani, G.; Jones, D. J.; et al. FRET-enhanced photoluminescence of perylene diimides by combining molecular aggregation and insulation. Journal of Materials Chemistry C 2020, 8 (26), 8953 - 8961 DOI: 10.1039/D0TC02108C. doi: 10.1039/D0TC02108C