Publications of Nico Spiller

Journal Article (3)

2022
Journal Article
Atanasov, M.; Spiller, N.; Neese, F. Magnetic Exchange and Valence Delocalization in a Mixed Valence [Fe2+Fe3+Te2]+ Complex: Insights from Theory and Interpretations of Magnetic and Spectroscopic Data. Physical Chemistry Chemical Physics 2022, 24, 20760–20775.
2021
Journal Article
Spiller, N.; Bjornsson, R.; DeBeer, S.; Neese, F. Carbon Monoxide Binding to the Iron–Molybdenum Cofactor of Nitrogenase: a Detailed Quantum Mechanics/Molecular Mechanics Investigation. Inorganic Chemistry 2021, 60, 18031–18047.
2020
Journal Article
Spiller, N.; Chilkuri, V. G.; DeBeer, S.; Neese, F. Sulfur Vs. Selenium as Bridging Ligand in Di‐Iron Complexes: A Theoretical Analysis. European Journal of Inorganic Chemistry 2020, 2020, 1525–1538.

Thesis - PhD (1)

2022
Thesis - PhD
Spiller, N. Electronic Structure Studies of Iron Sulfur Clusters from Model Compounds to the Active Site of Nitrogenase. PhD Thesis, Rheinische Friedrich-Wilhelms-Universität Bonn, Bonn, 2022.
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