Publikationen von Andreas Hansen

Zeitschriftenartikel (5)

2013
Zeitschriftenartikel
Riplinger, C.; Sandhoefer, B.; Hansen, A.; Neese, F. Natural triple excitations in local coupled cluster calculations with pair natural orbitals. The Journal of Chemical Physics 2013, 139.
2012
Zeitschriftenartikel
Ye, S.; Riplinger, C.; Hansen, A.; Krebs, C.; Bollinger Jr., J. M.; Neese, F. Electronic Structure Analysis of the Oxygen‐Activation Mechanism by FeII‐ and α‐Ketoglutarate (αKG)‐Dependent Dioxygenases. Chemistry – A European Journal 2012, 18, 6555–6567.
Zeitschriftenartikel
Huntington, L. M. J.; Hansen, A.; Neese, F.; Nooijen, M. Accurate thermochemistry from a parameterized coupled-cluster singles and doubles model and a local pair natural orbital based implementation for applications to larger systems. The Journal of Chemical Physics 2012, 136.
Zeitschriftenartikel
Izsák, R.; Hansen, A.; Neese, F. The resolution of identity and chain of spheres approximations for the LPNO-CCSD singles Fock term. Molecular Physics 2012, 110, 2413–2417.
2011
Zeitschriftenartikel
Hansen, A.; Liakos, D. G.; Neese, F. Efficient and accurate local single reference correlation methods for high-spin open-shell molecules using pair natural orbitals. The Journal of Chemical Physics 2011, 135.
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