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Notker Rösch

Technical University of Munich

76H-index
530Paper Count
2.1WCitation Count
Published Papers 137
Publication Date
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Single-Hydroxide Bridged Dimers of U and Np Actinyls: A Density Functional Study on Their Existence and Structure in Aqueous Solution
errINORGANIC CHEMISTRY
IF4.7
err2022-12-31
err3
PREAI
errChiorescu, Ion; Krueger, Sven; Roesch, Notker
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Leaching of palladium atoms from small cluster models during Heck reactions - An experimental and theoretical study
errCATALYSIS COMMUNICATIONS
IF4.3
err2022-05-01
err6
errOAAI
errWussow, Katharina; Abram, Andrea; Koehler, Klaus; Chang, Chun-Ran; Genest, Alexander; Li, Jun; Roesch, Notker
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The origin of the particle-size-dependent selectivity in 1-butene isomerization and hydrogenation on Pd/Al2O3 catalysts
errNATURE COMMUNICATIONS
IF15.7
err2021-10-20
err22
errOAAI
errGenest, Alexander; Silvestre-Albero, Joaquin; Li, Wen-Qing; Roesch, Notker; Rupprechter, Guenther
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Ethene Conversion at a Zeolite-Supported Ir(I) Complex. A Computational Perspective on a Single-Site Catalyst System
errCHEMCATCHEM
IF3.9
err2021-06-17
err3
errOAAI
errVummaleti, Sai V. C.; Genest, Alexander; Roesch, Notker
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How TeO Defects in the MoVNbTeO Catalyst Material Affect the V4+ Distribution: A Computational Study
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2020-08-14
err7
PREAI
errArce-Ramos, Juan Manuel; Genest, Alexander; Roesch, Notker
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Strain and Low-Coordination Effects on Monolayer Nanoislands of Pd and Pt on Au(111): A Comparative Analysis Based on Density Functional Results
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2020-05-27
err11
errOAAI
errSantana, Juan A.; Cruz, Bryan; Melendez-Rivera, Joshua; Roesch, Notker
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Uranyl(VI) sorption in calcium silicate hydrate phases. A quantum chemical study of tobermorite models
errAPPLIED GEOCHEMISTRY
IF3.4
err2020-02-01
err12
PREAI
errKremleva, Alena; Krueger, Sven; Roesch, Notker
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Interdisciplinary Round-Robin Test on Molecular Spectroscopy of the U(VI) Acetate System
errACS OMEGA
IF4.3
err2019-05-03
err8
errOAAI
errMueller, Katharina; Foerstendorf, Harald; Steudtner, Robin; Tsushima, Satoru; Kumke, Michael U.; Lefevre, Gregory; Rothe, Joerg; Mason, Harris; Szabo, Zoltan; Yang, Ping; Adam, Christian K. R.; Andre, Remi; Brennenstuhl, Katlen; Chiorescu, Ion; Cho, Herman M.; Creff, Gaelle; Coppin, Frederic; Dardenne, Kathy; Den Auwer, Christophe; Drobot, Bjoern; Eidner, Sascha; Hess, Nancy J.; Kaden, Peter; Kremleva, Alena; Kretzschmar, Jerome; Krueger, Sven; Platts, James A.; Panak, Petra J.; Polly, Robert; Powell, Brian A.; Rabung, Thomas; Redon, Roland; Reiller, Pascal E.; Roesch, Notker; Rossberg, Andre; Scheinost, Andreas C.; Schimmelpfennig, Bernd; Schreckenbach, Georg; Skerencak-Frech, Andrej; Sladkov, Vladimir; Solari, Pier Lorenzo; Wang, Zheming; Washton, Nancy M.; Zhang, Xiaobin
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C- C coupling at a zeolite- supported Rh.I) complex. DFT search for the mechanism
errCATALYSIS SCIENCE & TECHNOLOGY
IF4.2
err2019-01-01
err11
PREAI
errVummaleti, Sai V. C.; Kuriakose, Nishamol; Dinda, Shrabani; Wu, Yin; Genest, Alexander; Roesch, Notker
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Reactivity trends of the MoVOx mixed metal oxide catalyst from density functional modeling
errCATALYSIS SCIENCE & TECHNOLOGY
IF4.2
err2019-01-01
err14
PREAI
errLi, Wen-Qing; Fjermestad, Torstein; Genest, Alexander; Roesch, Notker
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Ethene Dimerization and Hydrogenation over a Zeolite-Supported Rh(I)-Carbonyl Complex: Mechanistic Insights from DFT Modeling
errACS CATALYSIS
IF13.1
err2018-09-26
err18
PREAI
errVummaleti, Sai V. C.; Genest, Alexander; Kuriakose, Nishamol; Roesch, Notker
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Modeling the Effect of the Electrolyte on Standard Reduction Potentials of Polyoxometalates
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2018-08-03
err4
PREAI
errKremleva, Alena; Roesch, Notker
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Catalytic Transformations of 1-Butene over Palladium. A Combined Experimental and Theoretical Study
errACS CATALYSIS
IF13.1
err2018-05-24
err15
PREAI
errMarkova, Velina K.; Philbin, John P.; Zhao, Weina; Genest, Alexander; Silvestre-Albero, Joaquin; Rupprechter, Guenther; Roesch, Notker
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Ethanol Conversion to Ethylene and Acetaldehyde over Rhodium(I) Exchanged Faujasite Zeolite. A QM/MM and Microkinetic Study
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2018-01-25
err5
PREAI
errMarkova, Velina; Rugg, Graham; Govindasamy, Agalya; Genest, Alexander; Roesch, Notker
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Modeling Polaron-Coupled Li Cation Diffusion in V2O5 Cathode Material
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2018-01-02
err30
PREAI
errSuthirakun, Suwit; Genest, Alexander; Roesch, Notker
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How the distribution of reduced vanadium centers affects structure and stability of the MoVOx material
errCATALYSIS SCIENCE & TECHNOLOGY
IF4.2
err2018-01-01
err11
PREAI
errLi, Wenqing; Fjermestad, Torstein; Genest, Alexander; Roesch, Notker
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Palladium-Catalyzed Hydroxycarbonylation of Pentenoic Acids. Computational and Experimental Studies on the Catalytic Selectivity
errACS CATALYSIS
IF13.1
err2017-09-21
err28
PREAI
errZhao, Lili; Pudasaini, Bimal; Genest, Alexander; Nobbs, James D.; Low, Choon Heng; Stubbs, Ludger Paul; van Meurs, Martin; Roesch, Notker
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Size-Dependence of the Adsorption Energy of CO on Pt Nanoparticles: Tracing Two Intersecting Trends by DFT Calculations
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2017-08-08
err41
PREAI
errLaletina, Svetlana S.; Mamatkulov, Mikhail; Shor, Elena A.; Kaichev, Vasily V.; Genest, Alexander; Yudanov, Ilya V.; Roesch, Notker
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Combined EXAFS Spectroscopic and Quantum Chemical Study on the Complex Formation of Am(III) with Formate
errINORGANIC CHEMISTRY
IF4.7
err2017-06-02
err11
PREAI
errFroehlich, Daniel R.; Kremleva, Alena; Rossberg, Andre; Skerencak-Frech, Andrej; Koke, Carsten; Krueger, Sven; Roesch, Notker; Panak, Petra J.
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Quantum chemical modeling of tri-Mn-substituted W-based Keggin polyoxoanions
errELECTROCHIMICA ACTA
IF5.6
err2017-03-01
err10
errOAAI
errKremleva, Alena; Aparicio, Pablo A.; Genest, Alexander; Roesch, Notker
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Research Directions

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Co-authors
Cooperation Journals
R
Robert Huber
H-index: 147 · Papers: 746
H
Hans‐Joachim Freund
H-index: 120 · Papers: 988
J
Jun Li
H-index: 118 · Papers: 1.5K
G
Gernot Frenking
H-index: 116 · Papers: 1.4K
W
Wolfgang A. Herrmann
H-index: 114 · Papers: 1.6K
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