Publications of Sinjini Bhattacharjee

Bhattacharjee, S.; Gordiy, I.; Sirohiwal, A.; Pantazis, D. A.: Microscopic basis of reaction center modulation in PsbA variants of photosystem II. Proceedings of the National Academy of Sciences of the United States of America 122 (20), e2417963122 (2025)

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)