Molcas 8: New capabilities for multiconfigurational quantum chemical 
calculations across the periodic table

Aquilante, F.; Autschbach, J.; Carlson, R.; Chibotaru, L.; Delcey, M.; De Vico, L.; Galvan, I.; Ferre, N.; Frutos, L.; Gagliardi, L.; Garavelli, M.; Giussani, A.; Hoyer, C.; Li Manni, G.; Lischka, H.; Ma, D.; Malmqvist, P.; Muller, T.; Nenov, A.; Olivucci, M.; Pedersen, T.; Peng, D.; Plasser, F.; Pritchard, B.; Reiher, M.; Rivalta, I.; Schapiro, I.; Segarra-Marti, J.; Stenrup, M.; Truhlar, D.; Ungur, L.; Valentini, A.; Vancoillie, S.; Veryazov, V.; Vysotskiy, V.; Weingart, O.; Zapata, F.; Lindh, R.

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Molcas 8: New capabilities for multiconfigurational quantum chemical calculations across the periodic table

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Li Manni, G.
Max Planck Society;

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Aquilante, F., Autschbach, J., Carlson, R., Chibotaru, L., Delcey, M., De Vico, L., et al. (2016). Molcas 8: New capabilities for multiconfigurational quantum chemical calculations across the periodic table. Journal of Computational Chemistry, 37(5), 506-541.

Cite as: https://hdl.handle.net/21.11116/0000-000E-CDBE-6

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