Publications of Manuel Sparta

Sparta, M.; Retegan, M.; Pinski, P.; Riplinger, C.; Becker, U.; Neese, F.: Multilevel Approaches within the Local Pair Natural Orbital Framework. Journal of Chemical Theory and Computation 13 (7), pp. 3198 - 3207 (2017)

Schneider, W. B.; Bistoni, G.; Sparta, M.; Saitow, M.; Riplinger, C.; Auer, A. A.; Neese, F.: Decomposition of Intermolecular Interaction Energies within the Local Pair Natural Orbital Coupled Cluster Framework. Journal of Chemical Theory and Computation 12 (10), pp. 4778 - 4792 (2016)

Liakos, D. G.; Sparta, M.; Kesharwani, M. K.; Martin, J. M. L.; Neese, F.: Exploring the Accuracy Limits of Local Pair Natural Orbital Coupled-Cluster Theory. Journal of Chemical Theory and Computation 11 (4), pp. 1525 - 1539 (2015)

Sparta, M.; Neese, F.: Chemical applications carried out by local pair natural orbital based coupled-cluster methods. Chemical Society Reviews 43 (14), pp. 5032 - 5041 (2014)

Sparta, M.; Riplinger, C.; Neese, F.: Mechanism of Olefin Asymmetric Hydrogenation Catalyzed by Iridium Phosphino-Oxazoline: A Pair Natural Orbital Coupled Cluster Study. Journal of Chemical Theory and Computation 10 (3), pp. 1099 - 1108 (2014)