Publikationen von Dipayan Datta

Datta, D.; Saitow, M.; Sandhöfer, B.; Neese, F. ⁵⁷Fe Mössbauer parameters from domain based local pair-natural orbital coupled-cluster theory. The Journal of Chemical Physics 2020, 153, 204101.

Datta, D.; Kossmann, S.; Neese, F. Analytic energy derivatives for the calculation of the first-order molecular properties using the domain-based local pair-natural orbital coupled-cluster theory. The Journal of Chemical Physics 2016, 145, 114101.