Publikationen

2021

  • Möbius, K., Lubitz, W.,Savitsky, A. (2021). CIDEP-Enhanced ENDOR of short-lived radicals. Recollections of first joint experiments with Renad Sagdeev. RUSSIAN CHEMICAL BULLETIN,70(12), 2445-2456. doi:10.1007/s11172-021-3366
  • Sanchez-Bastardo, N., Schlögl, R.,  Ruland, H. (2021). Response to Comment on "Methane Pyrolysis for Zero-Emission Hydrogen Production: A Potential Bridge Technology from Fossil Fuels to a Renewable and Sustainable Hydrogen Economy". Industrial and Engineering Chemistry Research,60(48), 17795-17796. doi:10.1021/acs.iecr.1c04435.
  • Liu, C., Geer, A. M., Webber, C., Musgrave, C., Gu, S., Johnson, G., Dickie, D. A., Chabbra, S., Schnegg, A., Zhou, H., Sun, C.-J., Hwang, S., Goddard III, W. A., Zhang, S., Gunnoe, T. B. (2021). Immobilization of "Capping Arene" Cobalt(II) Complexes on Ordered Mesoporous Carbon for Electrocatalytic Water Oxidation. ACS Catalysis, (11), 15068-1508 DOI: 10.1021/acscatal.1c04617
  • Bukhtiyarov, A. V., Prosvirin, I. P., Panafidin, M. A., Fedorov, A. Y., Klyushin, A. Y., Knop-Gericke, A., Zubavichus, Y. V.,  Bukhtiyarov, V. I  (2021). Near-Ambient Pressure XPS and MS Study of CO Oxidation over Model Pd-Au/HOPG Catalysts: The Effect of the Metal Ratio. Nanomaterials, (11), 3292. doi:10.3390/nano11123292 .
  • Czastka, K., Alsheikh Oughli, A., Rüdiger, O.,  DeBeer, S. (2021). Enzymatic X-ray Absorption Spectroelectrochemistry. Faraday Discussions, (xx), 1-14. doi:10.1039/x0xx00000x.
  • Gerz, I., Venturinelli Jannuzzi, S. A., Hylland, K. T., Negri, C., Wragg, D. S., Öien-Ödegaard, S.,Tilset, M., Olybye, U., DeBeer, S.,  Amedjkouh, M. (2021). Structural Elucidation, Aggregation, and Dynamic Behaviour of N,N,N,N-Copper(I) Schiff Base Complexes in Solid and in Solution: A Combined NMR, X-ray Spectroscopic and Crystallographic Investigation. European Journal ofInorganic Chemistry. doi:10.1002/ejic.202100982.
  • Spiller, N. B., Bjornsson, R., DeBeer, S., Neese, F. (2021). Carbon Monoxide Binding to the Iron–Molybdenum Cofactor of Nitrogenase: a Detailed Quantum Mechanics/Molecular Mechanics Investigation. Inorganic Chemistry,60(23), 18031-18047. doi:10.1021/acs.inorgchem.1c02649.
  • Savitsky, A., Nalepa, A., Petrenko, T., Plato, M., Möbius, K.,  Lubitz, W. (2021). Hydrogen-Bonded Complexes of Neutral Nitroxide Radicals with 2-Propanol Studied by Multifrequency EPR/ ENDOR. Applied Magnetic Resonance, (xx), xx-xx. doi:10.1007/s00723-021-01442-y.
  • Schlögl, R. (2021). Chemical Batteries with CO2. Angewandte Chemie, International Edition inEnglish, (60), 2-25. doi:10.1002/anie.202007397.
  • Gordon, J. B., Albert, T., Dey, A., Sabuncu, S., Siegler, M. A., Bill, E., Moenne-Loccoz, P., Goldberg, D. P. (2021) A Reactive, Photogenerated High-Spin (S=2) Fe-IV(O) Complex via O-2 Activation. Journal of the American Chemical Society, (143), 21637-21647. doi:10.1021/jacs.1c10051.
  • Schlichter, P., Werlé, C. (2021) The Rise of Manganese-Catalyzed Reduction Reactions. Synthesis, (54) 517-534. doi:10.1055/a-1657-2634.
  • Müscher-Polzin, P., Poschmann, M., Näther, C.,  Bensch, W. (2021) Room Temperature Synthesis of [Pd(cyclam)](5){H3Nb6O19}(2). 26H(2)O: a Suitable Precursor for the in-situ Generation of a Highly Active Catalyst for Light-Driven Hydrogen Evolution. European Journal of Inorganic Chemistry (43) 4482-4488. doi:10.1002/ejic.202100616.
  • Dreyer, M., Cruz, D., Hagemann, U., Zeller, P., Heidelmann, M., Salamon, S., Landers,J., Rabe,A., Ortega,K.F. , Najafishirtari,S., Wende,H., Hartmann,N., Knop-Gericke,A., Schlögl,R., Behrens,M. (2021) The Effect of Water on the 2-Propanol Oxidation Activity of Co-Substituted LaFe1-CoxO3 Perovskites. SI(27) 17127-17144 doi:10.1002/chem.202102791.
  • Guntermann, N., Mengers, H. G., Francio, G., Blank, L. M.,  Leitner, W. (2021) Bio-energy conversion with carbon capture and utilization (BECCU): integrated biomass fermentation and chemo-catalytic CO2 hydrogenation for bioethanol and formic acid co-production. Green Chemistry (24) 9860-9864. doi:10.1039/d1gc02915k.
  • Cramer, H. H., Ye, S., Neese, F., Werlé, C., Leitner, W. (2021) Cobalt-Catalyzed Hydrosilylation of Carbon Dioxide to the Formic Acid, Formaldehyde, and Methanol Level-How to Control the Catalytic Network? JACS Au (11) 2058-2069. doi:10.1021/jacsau.1c00350.
  • Chang, W.-C., Deufel, F., Weyhermüller, T., Fares, C.,  Werlé, C. (2021). Rhodium(I) complexes derived from tris(isopropyl)-azaphosphatrane-controlling the metal-ligand interplay. RSC Advances (11) 37383-37391. doi:10.1039/d1ra07126b.
  • Moustakas, N. G., Lorenz, F., Dilla, M., Peppel, T.,  Strunk, J. (2021) Pivotal Role of Holes in Photocatalytic CO2 Reduction on TiO2. ,Chem.Eur.J. (27) 17213-17219. doi:10.1002/chem.202103070.
  • Kinzel, N. W., Demirbas, D., Bill, E., Weyhermüller, T., Werlé, C., Kaeffer, N., Leitner, W. (2021) Systematic Variation of 3d Metal Centers in a Redox-Innocent Ligand Environment: Structures, Electrochemical Properties, and Carbon Dioxide Activation. Inorganic Chemistry, (60)19062-19078. doi:10.1021/acs.inorgchem.1c02909.
  • Perdomenico, J., Levin, N., Fierro, A. C., Chernek, O. A. C., Weyhermüller, T., Slep, L. D. (2021) A New Member of the Growing Family of Interconvertible {RuNO}(6,7,8) Species. Redox and Acid-Base Characterization of [Ru((CH(2)py)(2)Me[9]aneN(3))(NO)](n+). European Journal of Inorganic Chemistry, 4842-4855. doi:10.1002/ejic.202100753.
  • Panafidin, M. A., Bukhtiyarov, A. V., Prosvirin, I. P., Chetyrin, I. A., Klyushin, A. Y., Knop-Gericke, A., Smirnova,N.S., Markov, P.V., Mashkovsky,L.S., Zubavichus, Y.V., Stakheev,A.Y., Bukhtiyarov, V.I. (2021) SRPES and STM data for the model bimetallic Pd-In/HOPG catalysts: Effects of mild post-synthesis oxidative treatments. Data in Brief (39) 107626, pp. 1-9. doi:10.1016/j.dib.2021.107626.
  • Narangoda, P., Spanos, I., Masa, J., Schlögl, R., Zeradjanin, A. R. (2021) Electrocatalysis Beyond 2020: How to Tune the Preexponential Frequency Factor. ChemElectroChem (8) 1-9. doi:10.1002/celc.202101278.
  • Groß, H., Poschmann, M., Gröneveld, D., König, J. D., Kienle, L., Bensch, W. (2021) Does Low-Level Substitution Aid in Improving Thermoelectric Properties? A Case Study of M0.1Ni0.9Cr2S4 (M = Mn, In). Advanced Engineering Materials,  2100828, pp. 1-7. doi:10.1002/adem.202100828.
  • Andronescu, C., Masa, J., Gooding, J. J. (2021) Celebrating Wolfgang Schuhmann's 65th Birthday. ChemElectroChem (8) 4349-4395  doi:10.1002/celc.202101368
  • Liu, J., Zou, Y., Cruz Lemus, S. D., Savateev, A., Antonietti, M., Vile, G. (2021) Ligand-Metal Charge Transfer Induced via Adjustment of Textural Properties Controls the Performance of Single-Atom Catalysts during Photocatalytic Degradation. ACS Applied Materials and Interfaces13(22) 25858-25867. doi:10.1021/acsami.1c02243.
  • Martini, M. A., Rüdiger, O., Breuer, N., Nöring, B., DeBeer, S., Rodriguez-Macia, P., Birrell, J.  (2021) The Nonphysiological Reductant Sodium Dithionite and [FeFe] Hydrogenase: Influence on the Enzyme Mechanism. Journal of the American Chemical Society (143)18159-18171. doi:10.1021/jacs.1c07322.
  • Thorhallsson, A. T., Bjornsson, R. (2021) The E-2 state of FeMoco: Hydride Formation versus Fe Reduction and a Mechanism for H-2 Evolution. Chemistry – A European Journal (27) 16788-16800. doi:10.1002/chem.202102730.
  • Salvador, F. E., Miller, V., Shimada, K., Wang, C.-H., Wright, J., Das, M., Chen, Y.-P., Chen, Y.-S., Sheehan, C., Xu, W., Rubasinghege, G., Gao, W.-Y. (2021) Mechanochemistry of Group 4 Element-Based Metal-Organic Frameworks. Inorganic Chemistry (60), 16079-16084. doi:10.1021/acs.inorgchem.1c02704.
  • Schlögl, R. (2021) Material Science for catalysis: Quo vadis? Zeitschrift für anorganische und allgemeine Chemie, (647),1998-2000 doi:10.1002/zaac.202100277.
  • Kreissl, H., Jin, J., Lin, S.-H., Schütte, D., Störtte, S., Levin, N., Chaudret, B., Vorholt, A., Bordet, A. Leitner, W. (2021) Commercial Cu2Cr2O5 Decorated with Iron Carbide Nanoparticles as Multifunctional Catalyst for Magnetically Induced Continuous Flow Hydrogenation of Aromatic Ketones. Angewandte Chemie, International Edition in English (60) 26639-26646. doi:10.1002/anie.202107916.
  • Broicher, C., Klingenhof, M., Frisch, M., Dresp, S., Kubo, N. M., Artz, J.,Radnik, J., Palkovits, S., Beine, A.K., Strasser, P., Palkovits, R. (2021) Particle size-controlled synthesis of high-performance MnCo-based materials for alkaline OER at fluctuating potentials. Catalysis Science & Technology, (11)7278-7286. doi:10.1039/d1cy00905b.
  • Walleck, S., Atanasov, M., Schnack, J., Bill, E., Stammler, A., Bögge, H., Glaser, T. (2021). Rational Design of a Confacial Pentaoctahedron: Anisotropic Exchange in a Linear (ZnFeFeFeZnII)-Fe-II-Fe-III-Fe-III-Zn-III Complex. Chemistry – A European Journal.(27) 15240-15251 doi:10.1002/chem.202102572.
  • Kaithal, A., Chatterjee, B., Werlé, C., Leitner, W. (2021). Acceptorless dehydrogenation of methanol to carbon monoxide and hydrogen using molecular catalysts. Angewandte Chemie, International Edition in English, (60) 26500-26505. doi:10.1002/anie.202110910.
  • Ronge, E., Ohms, J., Roddatis, V., Jones, T., Sulzmann, F., Knop-Gericke, A., Schlögl. R., Kurz, P.,Jooss, C., Skorupska, K. (2021). Operation of calcium-birnessite water-oxidation anodes: interactions of the catalyst with phosphate buffer anions. Sustainable Energy & Fuels, (5), 5535-5547. doi:10.1039/d1se01076j.
  • Hu, Y., Shen, Z., Li, B., Li, S., Yue, J., Zhao, G., Muhler, M., Wang, X. (2021) Solvent Effects on Photocatalytic Anaerobic Oxidation of Benzyl Alcohol over Pt-Loaded Defective SrTiO3 Nanoparticles. ACS Applied Nano Materials,4(9), 9254-9264. doi:10.1021/acsanm.1c01750.
  • Falk, T., Anke, S., Hajiyani, H., Saddeler, S., Schulz, S., Pentcheva, R., Peng, B., Muhler, M. (2021) Influence of the particle size on selective 2-propanol gas-phase oxidation over Co3O4 nanospheres. Catalysis Science & Technology, (11) 7552-7562. doi:10.1039/d1cy00944c.
  • Zenner, J., Moos, G., Luska, K. L., Bordet, A.Leitner, W. (2021). Rh NPs Immobilized on Phosphonium- based Supported Ionic Liquid Phases (Rh@SILPs) as Hydrogenation Catalysts. Chimia,75 (9) 724-732. doi:10.2533/chimia.2021.724.
  • Koch, G., Hävecker, M., Kube, P., Tarasov, A., Schlögl, R., Trunschke, A. (2021). The Influence of the Chemical Potential on Defects and Function of Perovskites in Catalysis. Frontiers in Chemistry,9, 746229-746229. doi:10.3389/fchem.2021.746229.
  • Zehnder, J., Cadalbert, R., Yulikov, M., Künze, G., Wiegand, T. (2021). Paramagnetic spin labeling of a bacterial DnaB helicase for solid-state NMR. Journal of Magnetic Resonance (332) 107075, pp. 1-12. doi:10.1016/j.jmr.2021.107075.
  • Zeradjanin, A. R., Narangoda, P., Spanos, I., Masa, J.,  Schlögl, R. (2021). How to minimise destabilising effect of gas bubbles on water splitting electrocatalysts? ,Current Opinion in Electrochemistry, (30): 100797. doi:10.1016/j.coelec.2021.100797.
  • Birrell, J. A., Rodriguez-Macia, P., Reijerse, E. J., Martini, M. A., Lubitz, W. (2021) The catalytic cycle of [FeFe] hydrogenase: A tale of two sites. Coordination Chemistry Reviews, (449) 214191. doi:10.1016/j.ccr.2021.214191.
  • Li, B., Geoghegan, B. L., Wölper, C., Cutsail III, G. E.,  Schulz, S. (2021). Redox Activity of Noninnocent 2,2 '-Bipyridine in Zinc Complexes: An Experimental and Theoretical Study. ACS Omega,6(28), 18325-18332. doi:10.1021/acsomega.1c02201.
  • Salazar Gomez, J. I., Sojka, M., Klucken, C., Schlögl, R.,  Ruland, H. (2021). Determination of trace compounds and artifacts in nitrogen background measurements by proton transfer reaction time-of-flight mass spectrometry under dry and humid conditions. Journal of Mass Spectrometry,56(8): e4777, pp. 1-22. doi:10.1002/jms.4777.
  • Asgeirsson, V., Birgisson, B. O., Bjornsson, R., Becker, U., Neese, F., Riplinger, C., Hannes, J. (2021) Nudged Elastic Band Method for Molecular Reactions Using Energy-Weighted Springs Combined with Eigenvector Following. Journal of Chemical Theory and Computation,17(8), 4929-4945. doi:10.1021/acs.jctc.1c00462.
  • Wang, H., Delacroix, S., Zieleniewska, A., Hou, J., Tarakina V, N., Cruz Lemus, S. D., Lauermann, I., Ferguson,J. L., Blackburn, J., Strauss, V., . (n.d.). In Situ Synthesis of Molybdenum Carbide Nanoparticles Incorporated into Laser-Patterned Nitrogen-Doped Carbon for Room Temperature VOC Sensing. Advanced Functional Materials, (31) 2104061,1-11pp. doi:10.1002/adfm.202104061
  • Schulte, Y., Geoghegan, B. L., Helling, C., Wölper, C., Haberhauer, G., Cutsail III, G. E., Schulz, S. (2021). Observation of Discrete Valence Tautomers in Crystalline Cyclopentadienyl Radicals. Journal of the American Chemical Society,143(32), 12658-12664. doi:10.1021/jacs.1c05210.
  • Sanchez-Bastardo, N., Schlögl, R.,  Ruland, H. (2021). Methane Pyrolysis for Zero-Emission Hydrogen Production: A Potential Bridge Technology from Fossil Fuels to a Renewable and Sustainable Hydrogen Economy. INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH,60(32), 11855-11881. doi:10.1021/acs.iecr.1c01679.
  • Türk, H., Schmidt, F. P., Götsch, T., Girgsdies, F., Hammud, A., Ivanov, D., Vinke, I.,de Haart, L.G.J.,Eichel, R.A., Reuter, K., Schlögl, R., Knop-Gericke, A., Scheurer, C., Lunkenbein, T. (2021). Complexions at the Electrolyte/Electrode Interface in Solid Oxide Cells. Advanced Materials Interfaces, (8): 2100967, pp. 1-9. doi:10.1002/admi.202100967.
  • Caspy, I., Neumann, E., Fadeeva, M., Liveanu, V., Savitsky, A., Frank, A., Kalisman,Y. L., Shkolnisky, Y., Murik,O., Treves, H., Hartmann, V., Nowaczyk, M. M., Schuhmann, W., Rögner, M., Willner, I., Kaplan, A., Schuister, G., Nelson, N., Lubitz, W., Nechushtai, R.  (2021). Cryo-EM photosystem I structure reveals adaptation mechanisms to extreme high light in Chlorella ohadii. Nature Plants, (7), 1314-1322. doi:10.1038/s41477-021-00983-1.
  • Weinert, H. M., Wölper, C., Haak, J., Cutsail, G. E., Schulz, S. (2021). Synthesis, structure and bonding nature of heavy dipnictene radical anions. Chemical Science, (12),14024-14032. doi:10.1039/d1sc04230k.
  • Monger, L. J., Razinkov, D., Bjornsson, R.,  Suman, S. G. (2021). Synthesis, Characterization, and Reaction Studies of Pd(II) Tripeptide Complexes. MOLECULES,26(17): 5169. doi:10.3390/molecules26175169.
  • Fairley, N., Fernandez, V., Richard-Plouet, M., Guillot-Deudon, C., Walton, J., Smith, E., Smith, E., Flahaut, D., Greiner, M., Biesinger, M., Tougaar, S., Morgan, D., Baltrusaitis, J. (2021). Systematic and collaborative approach to problem solving using X-ray photoelectron spectroscopy. Applied Surface Science Advances, (5): 100112, pp. 1-9. doi:10.1016/j.apsadv.2021.100112
  • Weidener, D., Klose, H., Graf von Westarp, W., Jupke, A., Leitner, W., De Maria, P. D., Grande,P.M.  (2021). Selective lignin fractionation using CO2-expanded 2-methyltetrahydrofuran (2-MTHF). Green Chemistry, (23), 6330-6336. doi:10.1039/D1GC01651B.
  • Malär, A. A., Wili, N., Völker, L. A., Kozlova I, M., Cadalbert, R., Däpp, A., Weber, M. E., Zehnder, J., Jeschke, G.,Eckert, H., Klose, D., Mulkijanian, A. Y., Meier, B. H., Wiegand, T. (2021). Spectroscopic glimpses of the transition state of ATP hydrolysis trapped in a bacterial DnaB helicase. Nature Communications, (12) 5293, pp. 1-13. doi:10.1038/s41467-021-25599-z.
  • Toghan, A., Greiner, M., Knop-Gericke, A., Imbihl, R. (2021). Identification of the surface species in electrochemical promotion: ethylene oxidation over a Pt/YSZ catalyst. PHYSICAL CHEMISTRY CHEMICAL PHYSICS, (23), 21591-21598. doi:10.1039/d1cp02757c.
  • Ott, J. C., Suturina, E. A., Kuprov, I., Nehrkorn, J., Schnegg, A., Enders, M., Lutz, H.G. (2021). Observability of paramagnetic NMR signals at over 10 000 ppm chemical shifts. Angewandte Chemie, International Edition in English, (60), 22856-22864. doi:10.1002/anie.202107944.
  • McPherson, J. N., Miller, C. J., Wegeberg, C., Chang, Y., Hedegard, E. D., Bill, E., Wait, T. D., McKenzie, C. J. (2021). Cooperative Co-Activation of Water and Hypochlorite by a Non-Heme Diiron(III) Complex. Journal of the American Chemical Society,143(37), 15400-15412. doi:10.1021/jacs.1c07669.
  • Ronge, E., Ohms, J., Roddatis, V., Jones, T., Sulzmann, F., Knop-Gericke, A., Schlögl, R., Kurz, P., Jooss, C., Skorupska, K. (2021). Operation of calcium-birnessite water-oxidation anodes: interactions of the catalyst with phosphate buffer anions. Sustainable Energy & Fuels, (5), 5535-5547. doi:10.1039/d1se01076j.
  • Foppa, L., Ghiringhelli, L. M., Girgsdies, F., Hashagen, M., Kube, P., Hävecker, M., Carey, S., Tarasov, A., Kraus, P., Rosowski, F., Schlögl, R., Trunschke, A., Scheffler, M. (2021). Materials genes of heterogeneous catalysis from clean experiments and artificial intelligence. MRS Bulletin, (46),1016-1026. doi:10.1557/s43577-021-00165-6.
  • Shin, D., Bhandari, S., Tesch, M. F., Bonke, S. A., Jaouen, F., Chabbra, S., Pratsch, C., Schnegg, A., Mechler, A.K. (2022). Reduced formation of peroxide and radical species stabilises iron-based hybrid catalysts in polymer electrolyte membrane fuel cells. Journal of Energy Chemistry,65, 433-438. doi.org/10.1016/j.jechem.2021.05.047 .  
  • Velasco Vélez, J., Carbonio, E. A., Chuang, C.-H., Hsu, C.-J., Lee, J.-F., Arrigo, R., Hävecker, M., Wang, R., Plodinec, M., Wamg, F.R., Centeno, A., Zurutuza, A., Falling, L.J., Mom, V., Hofmann, S., Schlögl, R., Knop-Gericke, A., Jones, T.,(2021). Surface Electron-Hole Rich Species Active in the Electrocatalytic Water Oxidation. Journal of the American Chemical Society, (143),12524-12534 . doi:10.1021/jacs.1c01655.
  • Gil-Sepulcre, M., Lindner, J. O., Schindler, D., Velasco, L., Moonshiram, D., Rüdiger, O., DeBeer, S., Stepanenko, V., Solano, E., Würthner, F., Llobet, A. (2021). Surface-Promoted Evolution of Ru-bda Coordination Oligomers Boosts the Efficiency of Water Oxidation Molecular Anodes. Journal of the American Chemical Society,143(30), 11651-11661. doi:10.1021/jacs.1c04738.
  • Rösler, T., Ehmann, K. R., Köhnke, K., Leutzsch, M., Wessel, N., Vorholt, A. J., Leitner, W.  (2021). Reductive hydroformylation with a selective and highly active rhodium amine system. Journal of Catalysis (400) 234-243. doi:10.1016/j.jcat.2021.06.001.
  • Budiyanto, E., Zerebecki, S., Weidenthaler, C., Kox, T., Kenmoe, S., Spohr, E., DeBeer, S., Rüdiger, O., Reichenberger, S., Barcikowski, S., Tuysuz, H., (2021). Impact of Single-Pulse, Low-Intensity Laser Post-Processing on Structure and Activity of Mesostructured Cobalt Oxide for the Oxygen Evolution Reaction. ACS applied materials & interfaces (13) 51962-51973 doi:10.1021/acsami.1c08034.
  • Zhao, Z., Choi, C., Hong, S., Shen, H., Yan, C., Masa, J., Jung,Y., Qiu, J., Sun,Z. (2021) Surface-engineered oxidized two-dimensional Sb for efficient visible light-driven N-2 fixation. Nano Energy, (78) 105368. doi:10.1016/j.nanoen.2020.105368.
  • Shen, H., Choi, C., Masa, J., Li, X., Qiu, J., Jung, Y., Sun, Z. (2021) Electrochemical ammonia synthesis: Mechanistic understanding and catalyst design. CHEM,7(7), 1708-1754. doi:10.1016/j.chempr.2021.01.009.
  • Büker, J., Huang, X., Bitzer, J., Kleist, W., Muhler, M., Peng, B. (2021) Synthesis of Cu Single Atoms Supported on Mesoporous Graphitic Carbon Nitride and Their Application in Liquid-Phase Aerobic Oxidation of Cyclohexene. ACS CATALYSIS, (11), 7863-7875. doi:10.1021/acscatal.1c01468.
  • Bardow, A., Bizzarri, C., Cao, X. E., Cowan, A. J., Cummings, C., Del Angel Hernandez, V., Doan, H.,  Dowson, G., Ghosh, S., Gil, V., Gugujonovic, K., Kamali, A. R., König, M., Leitner, W ., Luo, J., et.al.(2021). Emerging technologies: general discussion. Faraday Discussions ( 230 ) 388-412. doi:10.1039/d1fd90048j.
  • Brix, A. C., Morales, D. M., Braun, M., Jambrec, D., Junqueira, J. R. C., Cychy, S., Seisel,S.,Masa, J., Muhler, M., Andronescu, C., Schuhmann, W., (2021). Electrocatalytic Oxidation of Glycerol Using Solid-State Synthesised Nickel Boride: Impact of Key Electrolysis Parameters on Product Selectivity. ChemElectroChem, (8), 2336-2342. doi:10.1002/celc.202100739.
  • Pardo Perez, L. C., Teschner, D., Willinger, E., Guiet, A., Driess, M., Strasser, P.,Fischer ,A.(2021) In Situ Formed “Sn1–XInX@In1–YSnYOZ” Core@Shell Nanoparticles as Electrocatalysts for CO2 Reduction to Formate. Advanced Functional Materials, 2103601, pp. 1-14. doi:10.1002/adfm.202103601.
  • Zeradjanin, A. R., Narangoda, P., Spanos, I., Masa, J., Schlögl, R. (2021) Expanding the frontiers of hydrogen evolution electrocatalysis & ndash;searching for the origins of electrocatalytic activity in the anomalies of the conventional model. ELECTROCHIMICA ACTA,388: 138583. doi:10.1016/j.electacta.2021.138583.
  • Sahoo, S. K., Teixeira, I. F., Naik, A., Heske, J., Cruz , S. D., Antonietti, M., Savateev, A., Kühne, T. D. (2021) Photocatalytic Water Splitting Reaction Catalyzed by Ion-Exchanged Salts of Potassium Poly(heptazine imide) 2D Materials. The Journal of Physical Chemistry C,125(25), 13749-13758. doi:10.1021/acs.jpcc.1c03947.
  • Antico, E., Schlichter, P., Werle, C., Leitner, W. (2021) Reduction of Carboxylic Acids to Alcohols via Manganese(I) Catalyzed Hydrosilylation. JACS AU,1(6) 742-749. doi:10.1021/jacsau.1c00140.
  • Chatterjee, B., Jena, S., Chugh, V., Weyhermüller, T., Werle, C. (2021) A Molecular Iron-Based System for Divergent Bond Activation: Controlling the Reactivity of Aldehydes. ACS CATALYSIS,11(12), 7176-7185. doi:10.1021/acscatal.1c00733.
  • Geer, A. M., Musgrave III, C., Webber, C., Nielsen, R. J., McKeown, B. A., Liu, C.,Schleker, P. P. M., Jia, X., Dickie, D.A., Granwehr, J., Zhang, S., Machan,C W., Goddard, W.A., Gunnoe, T .B. (2021). Electrocatalytic Water Oxidation by a Trinuclear Copper (II) Complex. ACS Catalysis, (11), 7223-7240. doi:10.1021/acscatal.1c01395.
  • Sikdar, N., Schwiderowski, P., Medina, D., Dieckhöfer, S., Quast, T., Brix, A. C.,  Cychy, S., Muhler, M.,  Masa, J., Schuhmann, W. (2021) Construction of a Poly(anthraquinone Sulfide)/Carbon Nanotube Composite with Enhanced Li-ion Storage Capacity. CHEMELECTROCHEM,8(9) 1685-1693. doi:10.1002/celc.202100374.
  • Schlögl, R. (2021) Quo vadis carbocatalysis? Journal of Energy Chemistry,61, 219-227. doi:10.1016/j.jechem.2021.02.024.
  • Bordet, A., El Sayed, S., Sanger, M., Boniface, K. J., Kalsi, D., Luska, K. L., Jessop, P.; Leitner,W. (2021) Selectivity control in hydrogenation through adaptive catalysis using ruthenium nanoparticles on a CO2-responsive support. Nature chemistry (13) 916-922  doi:10.1038/s41557-021-00735-w.
  • Leitner, W., Schmitz, M. (2021) Concluding remarks: Carbon dioxide utilization: where are we now? and where are we going? Faraday discussions. (230) 413-426 doi:10.1039/d1fd00038a.
  • Fan, H., Folke, J., Liu, Z., Girgsdies, F., Ruland, H., Imlau, R., Ruland,H., Heumann, S., Granwehr, J.,Eichel,R.- A.,, Schlögl,R., Frei, E.,Xing, H. (2021) Ultrathin 2D Fe-Nanosheets Stabilized by 2D Mesoporous Silica: Synthesis and Application in Ammonia Synthesis. ACS Appl. Mater. Inerfaces,13(25), 30187-30197. doi:10.1021/acsami.1c06771
  • Wang, C.-H., DeBeer, S. (2021) Structure, reactivity, and spectroscopy of nitrogenase-related synthetic and biological clusters. CHEMICAL SOCIETY REVIEWS.(50) 8743-8761       doi:10.1039/d1cs00381j.
  • Hu, B., Li, X., Busser, W., Schmidt, S., Xia, W., Li, G., Li,X.; Peng,B. (2021) The Role of Nitrogen-doping in the Catalytic Transfer Hydrogenation of Phenol to Cyclohexanone with Formic Acid over Pd supported on Carbon Nanotubes. Chemistry – A European Journal, (27) 10948-10956. doi:10.1002/chem.202100981.
  • Püschel, S., Störtte, S., Topphoff, J., Vorholt, A. J., Leitner, W. (2021) Green process design for reductive hydroformylation of renewable olefin cuts for drop-in diesel fuels. ChemSusChem, (14), 5226-5234. doi:10.1002/cssc.202100929.
  • Simondson, D., Chatti, M., Bonke, S. A., Tesch, M. F., Golnak, R., Xiao, J., Hoogeveen, D.A., Cherepanov, P.V., Gardiner, J.L., Tricoli, A., MacFarlane, Douglas R., Simonov, A. N.(2021) Stable Acidic Water Oxidation with a Cobalt-Iron-Lead Oxide Catalyst Operating via a Cobalt-Selective Self-Healing Mechanism. Angewandte Chemie, International Edition in English, (60) 15821-15826. doi:10.1002/anie.202104123.
  • Huang, X., Jones, T., Federov, A., Farra, R., Coperet, C., Schlögl, R., Willinger,M.-G. (2021). Phase Coexistence and Structural Dynamics of Redox Metal Catalysts Revealed by Operando TEM. Advanced Materials,(33) 2101772, pp. 1-11. doi:10.1002/adma.202101772.
  • Pelmenschikov, V., Birrell, J. A., Gee, L. B., Richers, C. P., Reijerse, E. J., Wang, H., Arragain, S.; Mishra, N.; Yoda, Y.; Matsuura, H .;Li, L.; Tamasaku, K.; Rauchfuss, T. B.; Lubitz, W., Cramer, S. P. (2021). Vibrational Perturbation of the [FeFe] Hydrogenase H-Cluster Revealed by (CH)-C-13-H-2-ADT Labeling. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,143(22), 8237-8243. doi:10.1021/jacs.1c02323.
  • Hausmann, J. N., Schlögl, R., Menezes, P. W.,  Driess, M. (2021) Is direct seawater splitting economically meaningful? Energy & Environmental Science, (14) 3679-3685. doi:10.1039/d0ee03659e.
  • Nehrkorn, J. P., Valuev, I. A., Kiskin, M. A., Bogomyakov, A. S., Suturina, E. A., Sheveleva, A. M., Ovcharenko, V., Holldack, K.,Herrmann, C., Fedin, M. V., Schnegg, A., Veber, S.L. (2021) Easy-plane to easy-axis anisotropy switching in a Co(ii) single-ion magnet triggered by the diamagnetic lattice. Journal of Materials Chemistry C, (9), 9446-9452. doi:10.1039/d1tc01105g.
  • Bone, A. N., Widener, C. N., Moseley, D. H., Liu, Z., Lu, Z., Cheng, Y., Daemen, L. L, Ozerov, M.,Telser, J., Thirunavukkuarasu, K., Smirnov, D., Greer, S. M.,  Hill, Stephen., Krzystek, J., Holldack, K., Aliabadi, A., Schnegg, A., Dunbar, K. R., Xue, Zi-Ling (2021) Applying Unconventional Spectroscopies to the Single-Molecule Magnets, Co(PPh3)(2)X-2 (X=Cl, Br, I): Unveiling Magnetic Transitions and Spin-Phonon Coupling. Chemistry – A European Journal, (27), 11110-11125. doi:10.1002/chem.202100705.
  • Kuß, D. A., Hölscher, M.,  Leitner, W. (2021) Hydrogenation of CO2 to Methanol with Mn-PNP-Pincer Complexes in the Presence of Lewis Acids: the Formate Resting State Unleashed. CHEMCATCHEM . (13) 3319-3323 doi:10.1002/cctc.202100649.
  • de Luna, G. S., Ho, P. H., Sacco, A., Hernandez, S., Velasco-Velez, J. J., Ospitali, F., Paglianti, A., Albonetti, S., Fornasari, G., Benito, P. (2021) AgCu Bimetallic Electrocatalysts for the Reduction of Biomass-Derived Compounds. ACS Applied Materials and Interfaces (13), 23675-23688. doi:10.1021/acsami.1c02896.
  • Gioria, E., Duarte-Correa, L., Bashiri, N., Hetaba, W., Schomaeker, R., Thomas, A. (2021) Rational design of tandem catalysts using a core-shell structure approach. Nanoscale Advances,3(12), 3454-3459. doi:10.1039/d1na00310k.
  • Major, G. H., Avval, T. G., Patel, D. I., Shah, D., Roychowdhury, T., Barlow, A. J., Pigram, Paul J., Greiner, M., Fernandez, V., Herrera-Gomez, A. Linford, M. R.(2021) A discussion of approaches for fitting asymmetric signals in X-ray photoelectron spectroscopy (XPS), noting the importance of Voigt-like peak shapes. Surface and Interface Analysis, (53), 689-707. doi:10.1002/sia.6958.
  • Falk, T., Budiyanto, E., Dreyer, M., Pflieger, C., Waffel, D., Büker, J., Weidenthaler, C., Ortega, K. F., Behrens, M., Tueysuez, H., Muhler, M., Peng, B. (2021) Identification of Active Sites in the Catalytic Oxidation of 2-Propanol over Co1+xFe2-xO4 Spinel Oxides at Solid/Liquid and Solid/Gas Interfaces. ChemCatChem,(13), 2942-2951. doi:10.1002/cctc.202100352.
  • Hartwig, C., Schweinar, K., Jones, T. E., Beeg, S., Schmidt, F.-P., Schlögl, R., Greiner, M . (2021). Isolated Pd atoms in a silver matrix: Spectroscopic and chemical properties. The Journal of Chemical Physics,154(18): 184703, pp. 1-10. doi:10.1063/5.0045936.
  • Zhong, L., Barreau, M., Caps, V., Papaefthimiou, V., Hävecker, M., Teschner, D., Baaziz, W., Borfecchia, E., Braglia, L., Zafeiratos, S. (2021). Improving the Catalytic Performance of Cobalt for CO Preferential Oxidation by Stabilizing the Active Phase through Vanadium Promotion. ACS Catalysis,11(9), 5369-5385. doi:10.1021/acscatal.0c05482.
  • Doll, J. S., Eichelmann, R., Hertwig, L. E., Bender, T., Kohler, V. J., Bill, E., Wadepohl,H.; Rosca,D.-A. (2021). Iron-Catalyzed Trimerization of Terminal Alkynes Enabled by Pyrimidinediimine Ligands: A Regioselective Method for the Synthesis of 1,3,5-Substituted Arenes. ACS Catalysis,11(9), 5593-5600. doi:10.1021/acscatal.1c00978.
  • Ding, Y., Zhang, L., Gu, Q., Spanos, I., Pfänder, N., Wu, K. H., Schlögl, R.,Heumann, S. (2021). Tuning of Reciprocal Carbon-Electrode Properties for an Optimized Hydrogen Evolution. ChemSusChem,14(12), 2547-2553. doi:10.1002/cssc.202100654.
  • Sarma, B. B., Agostini, G., Farpon, M. G., Marini, C., Pfänder, N., Prieto, G. (2021). Bottom-up assembly of bimetallic nanocluster catalysts from oxide-supported single-atom precursors. Journal of Materials Chemistry A,9(13), 8401-8415. doi:10.1039/d1ta00421b.
  • Pielsticker, L., Nicholls, R., Beeg, S., Hartwig, C., Klihm, G., Schlögl, R., Tougaard, S., Greiner, M.(2021) Inelastic electron scattering by the gas phase in near ambient pressure XPS measurements. Surface and Interface Analysis, (53) 605-617. doi:10.1002/sia.6947.
  • Jurgeleit, R., Grimm-Lebsanft, B., Flöser, B. M., Teubner, M., Buchenau, S., Senft, L., Hoffmann, J., Naumova, M., Näther, C., Ivanovic-Burmazovic, I., Rübhausen, M., Tuczek, F. (2021) Catalytic Oxygenation of Hydrocarbons by Mono-mu-oxo Dicopper(II) Species Resulting from O-O Cleavage of Tetranuclear Cu-I/Cu-II Peroxo Complexes. Angewandte Chemie, International Edition in English, (60), 14154-14162 . doi:10.1002/anie.202101035
  • Schulz, C. E., Castillo, R. G., Pantazis, D. A., DeBeer, S.,  Neese, F. (2021) Structure-Spectroscopy Correlations for Intermediate Q of Soluble Methane Monooxygenase: Insights from QM/MM Calculations. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,143(17), 6560-6577. doi:10.1021/jacs.1c01180.
  • Stahl, B., Bredow, T.(2021) Surfaces of VO2-Polymorphs: Structure, Stability and the Effect of Doping. CHEMPHYSCHEM (22) 1018-1026  doi:10.1002/cphc.202000969.
  • Zalibera, M., Ziegs, F., Schiemenz, S., Dubrovin, V., Lubitz, W., Savitsky, A., Deng, S. H. M., Wang, X.-B., Avdoshenko, S., Popov, A.A. (2021) Metallofullerene photoswitches driven by photoinduced fullerene-to-metal electron transfer. Chemical Science(12) 7818-7838 doi:10.1039/d0sc07045a.
  • Mathe, Z., McCubbin Stepanic, O., Peredkov, S.,  DeBeer, S. (2021). Phosphorus K beta X-ray emission spectroscopy detects non-covalent interactions of phosphate biomolecules in situ. Chemical Science(12) 7888-7901 doi:10.1039/d1sc01266e.
  • Zhao, G., Bonke, S. A., Schmidt, S., Wang, Z., Hu, B., Falk, T., Hu, Y., Rath, T ., Xia, W ., Peng, B., Schnegg, A., Weng, Y., Muhler, M.(2021). Highly Efficient and Selective Aerobic Oxidation of Cinnamyl Alcohol under Visible Light over Pt-Loaded NaNbO3 Enriched with Oxygen Vacancies by Ni Doping. ACS Sustainable Chemistry & Engineering,9(15), 5422-5429. doi:10.1021/acssuschemeng.1c00460.
  • Griesser, C., Li, H., Wernig, E.- M., Winkler, D., Nia, N. S., Mairegger, T., Götsch, T. , Schachinger, T., Steiger-Thirsfeld, A ., Penner, S ., Wielend, D., Egger, D., Scheurer, C., Reuter, K., Kunze-Liebhäuser, J., (2021). True Nature of the Transition-Metal Carbide/Liquid Interface Determines Its Reactivity. ACS Catalysis,11(8), 4920-4928. doi:10.1021/acscatal.1c00415.
  • Jeske, K., Kizilkaya, A. C., Lopez-Luque, I., Pfänder, N., Bartsch, M., Concepcion, P., Prieto, G. (2021) Design of Cobalt Fischer-Tropsch Catalysts for the Combined Production of Liquid Fuels and Olefin Chemicals from Hydrogen-Rich Syngas. ACS Catalysis,11(8), 4784-4798. doi:10.1021/acscatal.0c05027.
  • Cutsail III, G. E., Ross, M. O., Rosenzweig, A. C., DeBeer, S. (2021) Towards a unified understanding of the copper sites in particulate methane monooxygenase: an X-ray absorption spectroscopic investigation dagger. Chemical Science, (12) 6194-6209. doi:10.1039/d1sc00676b.
  • Chee, S. W., Lunkenbein, T., Schlögl, R., Cuenya, B. R. (2021) In situ and operando electron microscopy in heterogeneous catalysis-insights into multi-scale chemical dynamics. Journal of Physics: Condensed Matter,33 (15) 153001, pp. 1-28. doi:10.1088/1361-648X/abddfd.
  • Bargiela, P., Fernandez, V., Cardinaud, C., Walton, J., Greiner, M., Morgan, D., Fairley,N., Baltrusaitis, J. (2021). Towards a reliable assessment of charging effects during surface analysis: Accurate spectral shapes of ZrO2 and Pd/ZrO2 via X-ray Photoelectron Spectroscopy. Applied Surface Science,566(566): 150728. doi:10.1016/j.apsusc.2021.150728.
  • Betancourt, C., Küppers, C., Piansawan, T., Sager, U., Hoyer, A. B., Kaminski, H., Rapp, G., John, A. C.,  Küpper, M., Quass, U., Kuhlbusch, T., Rudolph, J., Kiendler-Scharr, A., Gensch, I. (2021)  Firewood residential heating - local versus remote influence on the aerosol burden. Atmospheric Chemistry and Physics,21(8) 5953-5964. doi:10.5194/acp-21-5953-2021.
  • Lange, T., Reichenberger, S., Rohe, M., Bartsch, M., Kampermann, L., Klein, J., Schlögl, R.,  Barcikowski, S., (2021) Alumina-Protected, Durable and Photostable Zinc Sulfide Particles from Scalable Atomic Layer Deposition. Advanced Functional Materials,31(14) 2009323, pp. 1-15. doi:10.1002/adfm.202009323.
  • Schlögl, R. (2021) Chemical energy storage enables the transformation of fossil energy systems to sustainability. Green Chemistry,23(4) 1584-1593. doi:10.1039/d0gc03171b.
  • Löffler, S., Stöger-Pollach, M., Steiger-Thirsfeld, A., Hetaba, W., Schattschneider, P. (2021) Exploiting the Acceleration Voltage Dependence of EMCD. Materials,14(5) 1314, pp. 1-14. doi:10.3390/ma14051314.
  • Zhang, L., Bill, E., Kroneck, P. M. H., Einsle, O. (2021). A [3Cu:2S] cluster provides insight into the assembly and function of the Cu-Z site of nitrous oxide reductase. Chemical Science,12(9), 3239-3244. doi:10.1039/d0sc05204c.
  • Hardt, S., Stapf, S., Filmon, D. T., Birrell, J. A., Rüdiger, O., Fourmond, V.,  Léger, C.; Plumeré, N. (2021) Reversible H-2 oxidation and evolution by hydrogenase embedded in a redox polymer film. Nature Catalysis,4(3), 251-258. doi:10.1038/s41929-021-00586-1.
  • Bordet, A., Leitner, W. (2021). Metal Nanoparticles Immobilized on Molecularly Modified Surfaces: Versatile Catalytic Systems for Controlled Hydrogenation and Hydrogenolysis. Accounts of Chemical Research, (54),2144-2157. doi:10.1021/acs.accounts.1c00013.
  • Amati, M., Gregoratti, L., Zeller, P., Greiner, M., Scardamaglia, M., Junker, B., Russ, T., Weimar, U., Barsan, N., Favaro, M., Alharbi, A., Jensen, I. J. T., Ali, A., Belle, B. D. (2021). Near ambient pressure photoelectron spectro-microscopy: from gas-solid interface to operando devices. Journal of Physics D: Applied Physics,54(20): 204004, pp. 1-14. doi:10.1088/1361-6463/abe5e2.
  • Gomez Castillo, R., Hahn, A. W., van Kuiken, B. E., Henthorn, J. T., McGale, J., DeBeer, S. (2021) Probing Physical Oxidation State by Resonant X-ray Emission Spectroscopy: Applications to Iron Model Complexes and Nitrogenase. Angewandte Chemie, International Edition in English, (60), 10112-10121. doi:10.1002/anie.202015669.
  • Song, Y., Junqueira, J. R. C., Sikdar, N., Öhl, D., Dieckhöfer, S., Quast, T., Seisel, S., Masa, J., Andronescu, C., Schuhmann, W. (2021). B-Cu-Zn Gas Diffusion Electrodes for CO2 Electroreduction to C2+ Products at High Current Densities. Angewandte Chemie, International Edition in English,60,9135-9141. doi:10.1002/anie.202016898
  • Tarrago, M., Römelt, C., Nehrkorn, J., Schnegg, A., Neese, F., Bill, E.,  Ye, S. (2021) Experimental and Theoretical Evidence for an Unusual Almost Triply Degenerate Electronic Ground State of Ferrous Tetraphenylporphyrin. Inorganic chemistry (60) 4966-4985 doi:10.1021/acs.inorgchem.1c00031.
  • Nehrkorn, J. P., Greer, S. M., Malbrecht, B. J., Anderton, K. J., Azat Aliabadi, K., Schnegg, A.,  Holldack, K., Herrmann, C., Betley, T., Stoll, S., Hill, S. (2021). Spectroscopic Investigation of a Metal–Metal-Bonded Fe6 Single-Molecule Magnet with an Isolated S = 19/2 Giant-Spin Ground State. Inorganic Chemistry, (60), 4610-4622. doi:10.1021/acs.inorgchem.0c03595.
  • Warm, K., Paskin, A., Kuhlmann, U., Bill, E., Swart, M., Haumann, M., Dau, H., Hildebrandt, P.,  Ray, K. (2021). A Pseudotetrahedral Terminal Oxoiron(IV) Complex: Mechanistic Promiscuity in C-H bond Oxidation Reactions. Angewandte Chemie, International Edition in English, (60), 6752-6756. doi:10.1002/anie.202015896.
  • Schrimpf, M., Esteban, J., Warmeling, H., Färber, T.,Behr, A., Vorholt, A. J. (2021) Taylor-Couette reactor: Principles, design, and applications. Aiche Journal, Early Access 67:e17228 https://doi 10.1002/aic.17228
  • Velasco-Velez, J.-J., Falling, L. J., Bernsmeier, D., Sear, M. J., Clark, P. C. J., Chan, T.-S., Stotz, E., Hävecker, M., Kraehnert, R., Knop-Gericke, A., Chuang, C.-H., Starr, D. E., Favaro, M.,Mom V, R. (2021). A comparative study of electrochemical cells for in situ x-ray spectroscopies in the soft and tender x-ray range. Journal of Physics D: Applied Physics,54(12): 124003, pp. 1-14. doi:10.1088/1361-6463/abd2ed.
  • Hu, B., Warczinski, L., Li, X., Lu, M., Bitzer, J., Heidelmann, M., Eckhard, T., Schulwitz, J., Merko, M., Li, M., Kleist, W., Hättig, C.,Muhler, M., Peng, B. (2021). Formic Acid-Assisted Selective Hydrogenolysis of 5-Hydroxymethylfurfural to 2,5-Dimethylfuran over Bifunctional Pd Nanoparticles Supported on N-Doped Mesoporous Carbon. Angewandte Chemie, International Edition in English, 60, 6807-6815. doi:10.1002/anie.202012816.
  • Tonauer, C. M., Köck, E.-M., Gasser, T. M., Fuentes-Landete, V., Henn, R., Mayr, S., Kirchler, C. G., Huck, C. W., Loerting, T. (2021). Near-Infrared Spectra of High-Density Crystalline H2O Ices II, IV, V, VI, IX, and XII The Journal of Physical Chemistry A (125) 1062-1068  https://doi.org/10.1021/acs.jpca.0c09764
  • Shit, M., Maity, S., Bera, S., Kumar Mudi, P., Biswas, B., Weyhermüller, T., Ghosh, P. (2021). Nickel (II) di-aqua complex containing water cluster: Synthesis, X-ray structure and catecholase activity New Journal of Chemistry, 45, 2221-2227 https://doi.org/10.1039/D0NJ05238H
  • Klingenhof, M., Hauke, P., Brückner, S., Dresp, S., Wolf, E., Nong, H.N., Spöri, Merzdorf, T., Bernsmeier, D., Teschner, D., Schlögl, R., Strasser, P. (2021). Modular Design of Highly Active Unitized Reversible Fuel Cell Electrocatalysts ACS Energy Letters 6(1), 177-183. https://doi.org/10.1021/acsenergylett.0c02203
  • Chatterjee, S., Banerjee, S., Jana, R. D., Bhattacharya, S., Chakraborty, B., Venturinelli Jannuzzi, S. A. (2021). Tuning the stereoelectronic factors of iron(II)-2-aminophenolate complexes for the reaction with dioxygen: oxygenolytic C-C bond cleavage vs. oxidation of complex. Dalton Transactions,(50),1901-1912. DOI: 10.1039/d0dt03316b
  • Rosenbach, H., Walla, E., Cutsail III, G. E., Birrell, J. A., Pascual-Ortiz, M., DeBeer, S., Fleig, U., Span, I. (2021). The Asp1 pyrophosphatase from S. pombe hosts a [2Fe-2S]2+ cluster in vivo. Journal of Biological Inorganic Chemistry (26) 93-108. https://doi:10.1007/s00775-020-01840-w.
  • Galynska, M., Asgeirsson, V., Jonsson, H., Bjornsson, R. (2021) Localized and Delocalized States of a Diamine Cation: Resolution of a Controversy. The Journal of Physical Chemistry Letters,12(4), 1250-1255. https://doi.org/10.1021/acs.jpclett.0c03651
  • Young, T. R., Martini, M. A., Foster, A. W., Glasfeld, A., Osman, D., Morton, R. J., Deery, E., Warren, M. J., Robinson, N. J. (2021). Calculating metalation in cells reveals CobW acquires CoII for vitamin B12 biosynthesis while related proteins prefer ZnII. Nature Communications, (12), 1195 pp.1-15. https://doi:10.1038/s41467-021-21479-8.
  • Peters, J. W., Einsle, O., Dean, D. R., DeBeer, S., Hoffman, B. M., Holland, P. L., Seefeldt, L. C. (2021) Comment on "Structural evidence for a dynamic metallocofactor during N2 reduction by Mo-nitrogenase". Science,371(6530). https://doi:10.1126/science.abe5481.
  • Zeradjanin, A. R., Masa, J., Spanos, I., Schlögl, R. (2021) Activity and Stability of Oxides During Oxygen Evolution Reaction---From Mechanistic Controversies Toward Relevant Electrocatalytic Descriptors. Frontiers in Energy Research,8: 613092. doi:10.3389/fenrg.2020.613092.
  • Zhang, L., Wu, K.-H., Ding, Y., Shi, W., Liu, S., Niu, Y., Zhang, B. (2021). Insight into the Metal-Support Interactions between Ruthenium and Nanodiamond-derived Carbon material for CO Oxidation. ChemCatChem (13),1368 –1374 doi:10.1002/cctc.202001748.
  • Keilwerth, M., Grunwald, L., Mao, W., Heinemann, F. W., Sutter, J., Bill, E., Meyer, K. (2021). Ligand Tailoring Toward an Air-Stable Iron(V) Nitrido Complex. Journal of the American Chemical Society,143(3), 1458-1465. https://doi:10.1021/jacs.0c11141.
  • Zhang, L., Bill, E., Kroneck, P. M. H., Einsle, O. (2021). Histidine-Gated Proton-Coupled Electron Transfer to the CuA Site of Nitrous Oxide Reductase. Journal of the American Chemical Society,143(2), 830-838. https://doi:10.1021/jacs.0c10057.
  • Kinzel, N. W., Werlé, C., Leitner, W. (2021). Transition Metal Complexes as Catalysts for the Electroconversion of CO2: An Organometallic Perspective. Angewandte Chemie, International Edition in English, (60), 11268-11686. https://doi.org/10.1002/anie.202006988
  • Nong, H. N., Falling, L. J., Bergmann, A., Klingenhof, M., Tran, H. P., Spori, C., Mom, R., Timoshenko, J., Zichittella, G.,Knop-Gericke, A., Piccinin, S., Perez-Ramirez, J., Cuenya, B. R., Schlögl, R., Strasser, P., Teschner, D., Jones, T. E. (2021). Key role of chemistry versus bias in electrocatalytic oxygen evolution (vol 587, pg 408, 2020). Nature, E8. https://www.nature.com/articles/s41586-020-03141-3.pdf
  • Stühmeier, B. M., Greiner, M. T., Sureshwaran, V., Schuster, L., Tiah, L. H., Schwämmlein, J. N., Gasteiger, H. A., El-Sayed, H. A. (2021). Extending the Polyol Reduction Process into the Second Dimension: Oxide Thin Film Reduction. Journal of the Electrochemical Society, (168) 014506. https://doi:10.1149/1945-7111/abda22.
  • Duan, P.-C., Schulz, R. A., Römer, A., Van Kuiken, B. E., Dechert, S., Demeshko, S., Cutsail III, G. E., DeBeer, S., Mata, R. A., Meyer, F. (2021) Ligand Protonation Triggers H-2 Release from a Dinickel Dihydride Complex to Give a Doubly "T"-Shaped Dinickel(I) Metallodiradical. Angewandte Chemie, International Edition in English,60(4), 1891-1896. https://doi:10.1002/anie.202011494.
  • Kaithal, A., Hölscher, M., Leitner, W. (2021). Carbon monoxide and hydrogen (syngas) as a C1-building block for selective catalytic methylation Chemical Science 12,976-982 https://doi.org/10.1039/D0SC05404F
  • Cipriani, M., Bjornsson, R., Barclay, M., Terfort, A., Fairbrother, D.H., Ingólfssin, O. (2021). Relative cross sections and appearance energies in electron impact ionization and dissociation of mono-halogenated biphenyls International Journal of Mass Spectrometry 459, 116452. https://doi.org/10.1016/j.ijms.2020.116452
  • Peng, B., Zhu, X., Constales, D., Yablonsky, G.S. (2021). Experimental verification of conservatively perturbed equilibrium for a complex non-linear chemical reaction Chemical Engineering Science 229, 116008. https://doi.org/10.1016/j.ces.2020.116008
  • Weidener, D, Leitner, W., Domínguez de María, P., Klose, H., Grande, P.M. (2021). Lignocellulose fractionation using recyclable phosphoric acid: Lignin, cellulose and furfural production. ChemSusChem 14, 909–916 https://doi.org/10.1002/cssc.202002383
  • Wu, S., Yu, L., Wen, G., Xie, Z., Lin, Y. (2021). Recent progress of carbon-based metal-free materials in thermal-driven catalysis Journal of Energy Chemistry 58, 318-335. https://doi.org/10.1016/j.jechem.2020.10.011
  • Van Stappen, C., Decamps, L., DeBeer, S. (2021). Preparation and Spectroscopic Characterization of Lyophilized Mo Nitrogenase Journal of the Biological Inorganic Chemistry  26:81–91 https://doi.org/10.1007/s00775-020-01838-4   
  • Rengshausen, S., Van Stappen, C., Levin, N., Tricard, S., Luska, K.L., DeBeer, S., Chaudret, B., Bordet, A., Leitner, W. (2021). 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 17, 2006683 https://doi.org/10.1002/smll.202006683
  • Spanos, I., Masa, J., Zeradjanin, A., Schlögl, R. (2021). The Effect of Iron Impurities on Transition Metal Catalysts for the Oxygen Evolution Reaction in Alkaline Environment: Activity Mediators or Active Sites? Catalysis Letters 151,1843-1856 https://doi.org/10.1007/s10562-020-03478-4