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Maganas D, Kowalska JK, Van Stappen C, et al. (2020) Mechanism of L-edge x-ray magnetic circular dichroism intensity from quantum chemical calculations and experiment-A case study on V/V complexes. The Journal of Chemical Physics. 152: 114107
Kowalska J, Henthorn J, Van Stappen C, et al. (2019) X-ray Magnetic Circular Dichroism Spectroscopy Applied to Nitrogenase and Related Models: Experimental Evidence for a Spin-Coupled Mo(III). Angewandte Chemie (International Ed. in English)
Maganas D, Kowalska JK, Nooijen M, et al. (2019) Comparison of multireference ab initio wavefunction methodologies for X-ray absorption edges: A case study on [Fe(II/III)Cl] molecules. The Journal of Chemical Physics. 150: 104106
Chantzis A, Kowalska JK, Maganas D, et al. (2018) Ab initio Wavefunction-based Determination of Element Specific Shifts for the Efficient Calculation of X-Ray Absorption Spectra of Main Group Elements and First Row Transition Metals. Journal of Chemical Theory and Computation
Leipzig BK, Rees JA, Kowalska JK, et al. (2018) How Do Ring Size and π-Donating Thiolate Ligands Affect Redox-Active, α-Imino-N-heterocycle Ligand Activation? Inorganic Chemistry
Kowalska JK, Nayyar B, Rees JA, et al. (2017) Iron L2,3-Edge X-ray Absorption and X-ray Magnetic Circular Dichroism Studies of Molecular Iron Complexes with Relevance to the FeMoco and FeVco Active Sites of Nitrogenase. Inorganic Chemistry
Rees JA, Bjornsson R, Kowalska JK, et al. (2017) Comparative electronic structures of nitrogenase FeMoco and FeVco. Dalton Transactions (Cambridge, England : 2003)
Rees JA, Wandzilak A, Maganas D, et al. (2016) Experimental and theoretical correlations between vanadium K-edge X-ray absorption and K[Formula: see text] emission spectra. Journal of Biological Inorganic Chemistry : Jbic : a Publication of the Society of Biological Inorganic Chemistry. 21: 793-805
Kowalska JK, Hahn AW, Albers A, et al. (2016) X-ray Absorption and Emission Spectroscopic Studies of [L2Fe2S2](n) Model Complexes: Implications for the Experimental Evaluation of Redox States in Iron-Sulfur Clusters. Inorganic Chemistry
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