Publications of Sinjini Bhattacharjee

Šrut, A.; Bhattacharjee, S.; Pantazis, D. A.; Krewald, V.: Analyzing spectral distributions of charge transfer character in ensembles: a case study on the reaction center of photosystem II. Physical Chemistry Chemical Physics 27 (16), pp. 8327 - 8334 (2025)

Drosou, M.; Bhattacharjee, S.; Pantazis, D. A.: Combined Multireference–Multiscale Approach to the Description of Photosynthetic Reaction Centers. Journal of Chemical Theory and Computation 20 (16), pp. 7210 - 7226 (2024)

Bhattacharjee, S.; Arra, S.; Daidone, I.; Pantazis, D. A.: Excitation landscape of the CP43 photosynthetic antenna complex from multiscale simulations. Chemical Science 15 (19), pp. 7269 - 7284 (2024)

Ansari, M.; Bhattacharjee, S.; Pantazis, D. A.: Correlating Structure with Spectroscopy in Ascorbate Peroxidase Compound II. Journal of the American Chemical Society 146 (14), pp. 9640 - 9656 (2024)

Bhattacharjee, S.; Neese, F.; Pantazis, D. A.: Triplet states in the reaction center of Photosystem II. Chemical Science 14 (35), pp. 9503 - 9516 (2023)

Bhattacharjee, S.; Isegawa, M.; Garcia-Ratés, M.; Neese, F.; Pantazis, D. A.: Ionization Energies and Redox Potentials of Hydrated Transition Metal Ions: Evaluation of Domain-Based Local Pair Natural Orbital Coupled Cluster Approaches. Journal of Chemical Theory and Computation 18 (3), pp. 1619 - 1632 (2022)

Bhattacharjee, S.: Multiscale Simulations of Excited States and Redox Properties of Biomolecular Systems. Dissertation, 189 pp., Universität Duisburg-Essen, Duisburg-Essen (2024)