Publications

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2021

Kuß, D.A.; Hölscher, M.; Leitner, W., Hydrogenation of CO2 to methanol with Mn-PNP-Pincer complexes in the presence of Lewis acids: the formate resting state unleashed. ChemCatChem. https://doi.org/10.1002/cctc.202100649, in press.

Schulz, C. E.Castillo, R. G.; Pantazis, D. A.; DeBeer, S.; Neese, F., Structure-spectroscopy correlations fori intermediate Q of soluble methane monooxygenase: insights from QM/MM calculations. J. Am. Chem. Soc. 2021, 143, 6560-6577,  https://doi.org/10.1021/jacs.1c01180.

Stahl, B.; Bredow, T., Surfaces of VO2-polymorphs: structure, stability and the effect of doping. ChemPhysChem 2021, 22, 1018-1026, https://doi.org/10.1002/cphc.202000969.

Talebi-Moghaddam, S.; Robinson-Enebeli, S.; Musikhin, S.; Clavel, D. J.; Corbin, J. C.; Klinkova, A.; Smallwood, G. J.; Daun, K. J., Multiphoton induced photoluminescence during time-resolved laser-induced incandescence experiments on silver and gold nanoparticles. J. Appl. Phys. 2021, 129, 183107, https://doi.org/10.1063/5.0046702.

Schulz, C. E.; van Gastel, M.; Pantazis, D. A.; Neese, F., Converged structural and spectroscopic properties for refined QM/MM models of Azurin. Inorg. Chem. 2021, 60, 7399-7412, https://doi.org/10.1021/acs.inorgchem.1c00640.

Angel, S.; Tapia, J. D.; Gallego, J.; Hagemann, U.; Wiggers, H., Spray-flame synthesis of LaMnO3+δ nanoparticles for selective CO oxidation (SELOX). Energy & Fuels 2021, 35, 4367-4376, https://doi.org/10.1021/acs.energyfuels.0c03659.

Castillo, R. G.; Hahn, A. W.; Van Kuiken, B. E.; Henthorn, J. T.; McGale, J.; DeBeer, S., Probing physical oxidation state by resonant X-ray emission spectroscopy: applications to iron model complexes and nitrogenase. Angew. Chem., Int. Ed. 2021, 60, 10112-10121, https://doi.org/10.1002/anie.202015669. German Edition: Angew. Chem. 2021, 133, 10200-10209, https://doi.org/10.1002/ange.202015669.

Dieckhöfer, S.; Öhl, D.; Junqueira, J. R. C.; Quast, T.; Turek, T.; Schuhmann, W., Probing the local reaction environment during high turnover carbon dioxide reduction with Ag-based gas diffusion electrodes. Chem. Eur. J. 2021, 27, 5906-5912, https://doi.org/10.1002/chem.202100387.

Krüger, J.; Wölper, C.; Schulz, S., From π-bonded gallapnictenes to nucleophilic, redox-active metal-coordinated pnictanides. Angew. Chem., Int. Ed., 2021, 60, 3572-3575, https://doi.org/10.1002/anie.202013618. German Edition: Angew. Chem., 2021, 60, 3615-3618, https://doi.org/10.1002/ange.202013618.

Planchestainer, M.; McMaster, J.; Schulz, C.; Paradisi, F.; Albrecht, M., Carbene-induced rescue of catalytic activity in deactivated nitrite reductase mutant. Chem. Eur. J. 2020, 26, 15206-15211, https://doi.org/10.1002/chem.202002444.

Rengshausen, S.; Van Stappen, C.; Levin, N.; Tricad, S.; Luska, K. L.; DeBeer, S.; Chaudret, B.; Bordet, A.; Leitner, W., Organometallic synthesis of bimetallic cobalt-rhodium nanoparticles in supported ionic liquid phases (CoxRh100-x@SILP) as catalysts for the selective hydrogenation of multifunctional aromatic substrates. Small 2021, 17, 2006683. https://doi.org/10.1002/smll.202006683.

Salloum, S.; Bendt, G.; Heidelmann, M.; Loza, K.; Bayesteh, S.; Sepideh Izadi, M.; Kawulok, P.; He, R.; Schlörb, H.; Perez, N.; Reith, H.; Nielsch, K. ; Schierning, G.; Schulz, S., Influence of nanoparticle processing on the thermoelectric properties of (BixSb1−X)2Te3 ternary alloys. ChemOpen 2021, 10, 189-198, doi.org10.1002/open.202000257.

Yu, M.; Li, G.; Fu, C.; Liu, E.; Manna, K.; Budiyanto, E.; Yang, Q.; Felser, C.; Tüysüz, H., Tunable eg orbital occupancy in Heusler compounds for oxygen evolution reaction. Angew. Chem., Int. Ed. 2021, 60, 5800-5805, https://doi.org/10.1002/anie.202013610. German Edition: Angew. Chem. 2021, 133, 5864-5869, https://doi.org/10.1002/ange.202013610

News

The conference, “Exploring Reactivity with Spectroscopy” (ExpReS 2021), which was organised by students of the IMPRS-RECHARGE program, was held in an…

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Anna Ulpe, doctoral student at Mulliken Center for Theoretical Chemistry (Rheinische Friedrich-Wilhelms-Universität Bonn) under the supervision of…

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Rebeca Gomez Castillo, doctoral student in the group 'Inorganic Spectroscopy' under the supervision of Prof. Serena DeBeer (MPI CEC) successfully…

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