Publications of Igor Schapiro

Lazorski, M. S.; Schapiro, I.; Gaddie, R. S.; Lehnig, A. P.; Atanasov, M.; Neese, F.; Steiner, U. E.; Elliott, C. M.: Spin-chemical effects on intramolecular photoinduced charge transfer reactions in bisphenanthroline copper(I)-viologen dyad assemblies. Chemical Science 11 (21), pp. 5511 - 5525 (2020)

Schapiro, I.; Neese, F.: SORCI for photochemical and thermal reaction paths: A benchmark study. Computational & Theoretical Chemistry 1040-1041, pp. 84 - 98 (2014)

Schapiro, I.; Sivalingam, K.; Neese, F.: Assessment of n-Electron Valence State Perturbation Theory for Vertical Excitation Energies. Journal of Chemical Theory and Computation 9 (8), pp. 3567 - 3580 (2013)

Schweinfurth, D.; Krzystek, J.; Schapiro, I.; Demeshko, S.; Klein, J.; Telser, J.; Ozarowski, A.; Su, C.-Y.; Meyer, F.; Atanasov, M. et al.; Neese, F.; Sarkar, B.: Electronic Structures of Octahedral Ni(II) Complexes with “Click” Derived Triazole Ligands: A Combined Structural, Magnetometric, Spectroscopic, and Theoretical Study. Inorganic Chemistry 52 (12), pp. 6880 - 6892 (2013)