Loading publications…
The last 5 uploaded publications
Electronic Structure of a Formal Iron(0) Porphyrin Complex Relevant to CO<sub>2</sub> Reduction
Christina Römelt, Jinshuai Song, Maxime Tarrago, Julian A. Rees, Maurice van Gastel, Thomas Weyhermüller, Serena DeBeer, Eckhard Bill, Frank Neese, Shengfa Ye (2017). Electronic Structure of a Formal Iron(0) Porphyrin Complex Relevant to CO<sub>2</sub> Reduction. Inorganic Chemistry, 56(8), pp. 4745-4750, DOI: 10.1021/acs.inorgchem.7b00401.
Article169 days agoElectronic Structure and Spin Multiplicity of Iron Tetraphenylporphyrins in Their Reduced States as Determined by a Combination of Resonance Raman Spectroscopy and Quantum Chemistry
Christina Römelt, Shengfa Ye, Eckhard Bill, Thomas Weyhermüller, Maurice van Gastel, Frank Neese (2018). Electronic Structure and Spin Multiplicity of Iron Tetraphenylporphyrins in Their Reduced States as Determined by a Combination of Resonance Raman Spectroscopy and Quantum Chemistry. Inorganic Chemistry, 57(4), pp. 2141-2148, DOI: 10.1021/acs.inorgchem.7b03018.
Article169 days agoExperimental and Theoretical Evidence for an Unusual Almost Triply Degenerate Electronic Ground State of Ferrous Tetraphenylporphyrin
Maxime Tarrago, Christina Römelt, Joscha Nehrkorn, Alexander Schnegg, Frank Neese, Eckhard Bill, Shengfa Ye (2021). Experimental and Theoretical Evidence for an Unusual Almost Triply Degenerate Electronic Ground State of Ferrous Tetraphenylporphyrin. Inorganic Chemistry, 60(7), pp. 4966-4985, DOI: 10.1021/acs.inorgchem.1c00031.
Article169 days ago