Publikationen von Dipayan Datta

Zeitschriftenartikel (2)

2020
Zeitschriftenartikel
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.
2016
Zeitschriftenartikel
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.
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