Publications
Journal Article (3)
2009
Journal Article
2009 (30), pp. 6021 - 6036 (2009)
Multireference ab initio studies of zero-field splitting and magnetic circular dichroism spectra of tetrahedral Co(II) complexes. Dalton Transactions
Journal Article
48 (3), pp. 784 - 785 (2009)
Calibration of Modern Density Functional Theory Methods for the Prediction of 57Fe Mössbauer Isomer Shifts: Meta-GGA and Double-Hybrid Functionals. Inorganic Chemistry
Journal Article
13 (1), pp. 89 - 98 (2009)
Quantum chemical studies of C–H activation reactions by high-valent nonheme iron centers. Current Opinion in Chemical Biology