- Ruhr-Universität Bochum
Scientific output
Publications

Below, you can either scroll through the complete list of our annually published research in peer-reviewed journals or search for a specific author or keyword via the free text search.
- 2023 • 508
Promoting hydrogen evolution reaction with a sulfonic proton relay
Wang, N. and Zhang, X.-P. and Han, J. and Lei, H. and Zhang, Q. and Zhang, H. and Zhang, W. and Apfel, U.-P. and Cao, R.
CHINESE JOURNAL OF CATALYSIS. Volume: 45 (2023) - 2023 • 507
Quantitative tests revealing hydrogen-enhanced dislocation motion in α-iron
Huang, L. and Chen, D. and Xie, D. and Li, S. and Zhang, Y. and Zhu, T. and Raabe, D. and Ma, E. and Li, J. and Shan, Z.
NATURE MATERIALS. Volume: (2023) - 2023 • 506
CVD Grown Tungsten Oxide for Low Temperature Hydrogen Sensing: Tuning Surface Characteristics via Materials Processing for Sensing Applications
Wilken, M. and Ciftyürek, E. and Cwik, S. and Mai, L. and Mallick, B. and Rogalla, D. and Schierbaum, K. and Devi, A.
SMALL. Volume: 19 (2023) - 2023 • 505
Catalytic effects of molybdate and chromate–molybdate films deposited on platinum for efficient hydrogen evolution
Diaz-Morales, O. and Lindberg, A. and Smulders, V. and Anil, A. and Simic, N. and Wildlock, M. and Alvarez, G.S. and Mul, G. and Mei, B. and Cornell, A.
JOURNAL OF CHEMICAL TECHNOLOGY AND BIOTECHNOLOGY. Volume: 98 (2023) - 2023 • 504
Concepts of Heterogeneously Catalyzed Liquid-Phase Oxidation of Cyclohexene with tert-Butyl Hydroperoxide, Hydrogen Peroxide and Molecular Oxygen
Büker, J. and Muhler, M. and Peng, B.
CHEMCATCHEM. Volume: 15 (2023) - 2023 • 503
Hydrogen-Based Direct Reduction of Iron Oxides
Raabe, D. and Springer, H. and Filho, I.S. and Ma, Y.
MINERALS, METALS AND MATERIALS SERIES. Volume: (2023) - 2023 • 502
Substrate-Gated Transformation of a Pre-Catalyst into an Iron-Hydride Intermediate [(NO)2(CO)Fe(μ-H)Fe(CO)(NO)2]− for Catalytic Dehydrogenation of Dimethylamine Borane
Tseng, Y.-T. and Pelmenschikov, V. and Iffland-Mühlhaus, L. and Calabrese, D. and Chang, Y.-C. and Laun, K. and Pao, C.-W. and Sergueev, I. and Yoda, Y. and Liaw, W.-F. and Chen, C.-H. and Hsu, I.-J. and Apfel, U.-P. and Caserta, G. and Lauterbach, L. and Lu, T.-T.
INORGANIC CHEMISTRY. Volume: 62 (2023) - 2023 • 501
Hydrogen Plasma Reduction of Iron Oxides
Raabe, D. and Klug, M.J. and Ma, Y. and Büyükuslu, Ö. and Springer, H. and Souza Filho, I.
MINERALS, METALS AND MATERIALS SERIES. Volume: (2023) - 2023 • 500
Increasing the O2 Resistance of the [FeFe]-Hydrogenase CbA5H through Enhanced Protein Flexibility
Rutz, A. and Das, C.K. and Fasano, A. and Jaenecke, J. and Yadav, S. and Apfel, U.-P. and Engelbrecht, V. and Fourmond, V. and Léger, C. and Schäfer, L.V. and Happe, T.
ACS CATALYSIS. Volume: 13 (2023) - 2023 • 499
In Vivo Assembly of Photosystem I-Hydrogenase Chimera for In Vitro PhotoH2 Production
Wang, P. and Frank, A. and Appel, J. and Boehm, M. and Strabel, N. and Nowaczyk, M.M. and Schuhmann, W. and Conzuelo, F. and Gutekunst, K.
ADVANCED ENERGY MATERIALS. Volume: 13 (2023) - 2023 • 498
Fundamentals of Green Steel Production: On the Role of Gas Pressure During Hydrogen Reduction of Iron Ores
Souza Filho, I.R. and Ma, Y. and Raabe, D. and Springer, H.
JOM. Volume: (2023) - 2022 • 497
Advancing Critical Chemical Processes for a Sustainable Future: Challenges for Industry and the Max Planck–Cardiff Centre on the Fundamentals of Heterogeneous Catalysis (FUNCAT)
Bowker, M. and DeBeer, S. and Dummer, N.F. and Hutchings, G.J. and Scheffler, M. and Schüth, F. and Taylor, S.H. and Tüysüz, H.
ANGEWANDTE CHEMIE - INTERNATIONAL EDITION. Volume: (2022) - 2022 • 496
Opening the pathway towards a scalable electrochemical semi-hydrogenation of alkynols via earth-abundant metal chalcogenides
Pellumbi, K. and Wickert, L. and Kleinhaus, J.T. and Wolf, J. and Leonard, A. and Tetzlaff, D. and Goy, R. and Medlock, J.A. and junge Puring, K. and Cao, R. and Siegmund, D. and Apfel, U.-P.
CHEMICAL SCIENCE. Volume: (2022) - 2022 • 495
Introducing Water-Network-Assisted Proton Transfer for Boosted Electrocatalytic Hydrogen Evolution with Cobalt Corrole
Li, X. and Lv, B. and Zhang, X.-P. and Jin, X. and Guo, K. and Zhou, D. and Bian, H. and Zhang, W. and Apfel, U.-P. and Cao, R.
ANGEWANDTE CHEMIE - INTERNATIONAL EDITION. Volume: 61 (2022) - 2022 • 494
Advances and challenges in photosynthetic hydrogen production
Redding, K.E. and Appel, J. and Boehm, M. and Schuhmann, W. and Nowaczyk, M.M. and Yacoby, I. and Gutekunst, K.
TRENDS IN BIOTECHNOLOGY. Volume: 40 (2022) - 2022 • 493
Chemo-mechanical phase-field modeling of iron oxide reduction with hydrogen
Bai, Y. and Mianroodi, J.R. and Ma, Y. and da Silva, A.K. and Svendsen, B. and Raabe, D.
ACTA MATERIALIA. Volume: 231 (2022) - 2022 • 492
Comparison of the performance of a microwave plasma torch and a gliding arc plasma for hydrogen production via methane pyrolysis
Kreuznacht, S. and Purcel, M. and Böddeker, S. and Awakowicz, P. and Xia, W. and Muhler, M. and Böke, M. and Keudell, A.V.
PLASMA PROCESSES AND POLYMERS. Volume: (2022) - 2022 • 491
Plasma-Enhanced Atomic Layer Deposition of Molybdenum Oxide Thin Films at Low Temperatures for Hydrogen Gas Sensing
Wree, J.-L. and Rogalla, D. and Ostendorf, A. and Schierbaum, K.D. and Devi, A.
ACS APPLIED MATERIALS AND INTERFACES. Volume: (2022) - 2022 • 490
Interplay of Halogen and Weak Hydrogen Bonds in the Formation of Magic Nanoclusters on Surfaces
Bertram, C. and Miller, D.P. and Schunke, C. and Kemeny, I. and Kimura, M. and Bovensiepen, U. and Zurek, E. and Morgenstern, K.
JOURNAL OF PHYSICAL CHEMISTRY C. Volume: 126 (2022) - 2022 • 489
Bistable H2Pc Molecular Conductance Switch on Ag(100)
Kamiński, W. and Antczak, G. and Morgenstern, K.
JOURNAL OF PHYSICAL CHEMISTRY C. Volume: 126 (2022) - 2022 • 488
Hierarchical nature of hydrogen-based direct reduction of iron oxides
Ma, Y. and Souza Filho, I.R. and Bai, Y. and Schenk, J. and Patisson, F. and Beck, A. and van Bokhoven, J.A. and Willinger, M.G. and Li, K. and Xie, D. and Ponge, D. and Zaefferer, S. and Gault, B. and Mianroodi, J.R. and Raabe, D.
SCRIPTA MATERIALIA. Volume: (2022) - 2022 • 487
High-throughput discovery of hydrogen evolution electrocatalysts in the complex solid solution system Co-Cr-Fe-Mo-Ni
Schumacher, S. and Baha, S. and Savan, A. and Andronescu, C. and Ludwig, A.
JOURNAL OF MATERIALS CHEMISTRY A. Volume: (2022) - 2022 • 486
Oxygen vacancies-enriched Ta-doped Bi2WO6 with Pt as cocatalyst for boosting the dehydrogenation of benzyl alcohol in water
Shen, Z. and Hu, Y. and Pan, Q. and Huang, C. and Zhu, B. and Xia, W. and Wang, H. and Yue, J. and Muhler, M. and Zhao, G. and Wang, X. and Huang, X.
APPLIED SURFACE SCIENCE. Volume: 571 (2022) - 2022 • 485
Current developments in CO2 hydrogenation towards methanol: A review related to industrial application
Schwiderowski, P. and Ruland, H. and Muhler, M.
CURRENT OPINION IN GREEN AND SUSTAINABLE CHEMISTRY. Volume: 38 (2022) - 2022 • 484
Selective hydrogenation of highly concentrated acetylene streams over mechanochemically synthesized PdAg supported catalysts
Kley, K.S. and De Bellis, J. and Schüth, F.
CATALYSIS SCIENCE AND TECHNOLOGY. Volume: 13 (2022) - 2022 • 483
Probing the methanol-assisted autocatalytic formation of methanol over Cu/ZnO/Al2O3 by high-pressure methanol and methyl formate pulses
Schwiderowski, P. and Stürmer, S. and Muhler, M.
REACTION CHEMISTRY AND ENGINEERING. Volume: 7 (2022) - 2022 • 482
Hydrogen-based direct reduction of iron oxide at 700°C: Heterogeneity at pellet and microstructure scales
Ma, Y. and Souza Filho, I.R. and Zhang, X. and Nandy, S. and Barriobero-Vila, P. and Requena, G. and Vogel, D. and Rohwerder, M. and Ponge, D. and Springer, H. and Raabe, D.
INTERNATIONAL JOURNAL OF MINERALS, METALLURGY AND MATERIALS. Volume: 29 (2022) - 2022 • 481
Hydrogen-associated decohesion and localized plasticity in a high-Mn and high-Al two-phase lightweight steel
Dong, X. and Wang, D. and Thoudden-Sukumar, P. and Tehranchi, A. and Ponge, D. and Sun, B. and Raabe, D.
ACTA MATERIALIA. Volume: 239 (2022) - 2022 • 480
Hydrogen-assisted decohesion associated with nanosized grain boundary κ-carbides in a high-Mn lightweight steel
Elkot, M.N. and Sun, B. and Zhou, X. and Ponge, D. and Raabe, D.
ACTA MATERIALIA. Volume: 241 (2022) - 2022 • 479
Hydrogen trapping and embrittlement in high-strength Al alloys
Zhao, H. and Chakraborty, P. and Ponge, D. and Hickel, T. and Sun, B. and Wu, C.-H. and Gault, B. and Raabe, D.
NATURE. Volume: 602 (2022) - 2022 • 478
Bioelectrocatalytic CO2Reduction by Redox Polymer-Wired Carbon Monoxide Dehydrogenase Gas Diffusion Electrodes
Becker, J.M. and Lielpetere, A. and Szczesny, J. and Junqueira, J.R.C. and Rodríguez-Maciá, P. and Birrell, J.A. and Conzuelo, F. and Schuhmann, W.
ACS APPLIED MATERIALS AND INTERFACES. Volume: 14 (2022) - 2022 • 477
Non-oxidative Dehydrogenation of Methanol to Formaldehyde over Bulk β-Ga2O3
Merko, M. and Busser, G.W. and Muhler, M.
CHEMCATCHEM. Volume: 14 (2022) - 2022 • 476
Hydrogen Diffusion in Clinopyroxene at Low Temperatures (195°C–400°C) and Consequences for Subsurface Processes
Bissbort, T. and Lynn, K.J. and Becker, H.-W. and Chakraborty, S.
GEOCHEMISTRY, GEOPHYSICS, GEOSYSTEMS. Volume: 23 (2022) - 2022 • 475
High-pressure CO, H2, CO2 and Ethylene Pulses Applied in the Hydrogenation of CO to Higher Alcohols over a Bulk Co-Cu Catalyst
Telaar, P. and Schwiderowski, P. and Schmidt, S. and Stürmer, S. and Muhler, M.
CHEMCATCHEM. Volume: 14 (2022) - 2022 • 474
Rapid Water Diffusion at Cryogenic Temperatures through an Inchworm-like Mechanism
Fang, W. and Meyer auf der Heide, K.M. and Zaum, C. and Michaelides, A. and Morgenstern, K.
NANO LETTERS. Volume: 22 (2022) - 2022 • 473
Trimethylamine Probes Isolated Silicon Dangling Bonds and Surface Hydroxyls of (H,OH)-Si(001)
Ramírez, L.P. and Fornefeld, N. and Bournel, F. and Kubsky, S. and Magnano, E. and Bondino, F. and Köhler, U. and Carniato, S. and Gallet, J.-J. and Rochet, F.
JOURNAL OF PHYSICAL CHEMISTRY C. Volume: 126 (2022) - 2022 • 472
Controlled Doping of Electrocatalysts through Engineering Impurities
Kim, S.-H. and Yoo, S.-H. and Shin, S. and El-Zoka, A.A. and Kasian, O. and Lim, J. and Jeong, J. and Scheu, C. and Neugebauer, J. and Lee, H. and Todorova, M. and Gault, B.
ADVANCED MATERIALS. Volume: 34 (2022) - 2022 • 471
Origins of the hydrogen signal in atom probe tomography: Case studies of alkali and noble metals
Yoo, S.-H. and Kim, S.-H. and Woods, E. and Gault, B. and Todorova, M. and Neugebauer, J.
NEW JOURNAL OF PHYSICS. Volume: 24 (2022) - 2022 • 470
Electrocatalytic Conversion of Glycerol to Oxalate on Ni Oxide Nanoparticles-Modified Oxidized Multiwalled Carbon Nanotubes
Morales, D.M. and Jambrec, D. and Kazakova, M.A. and Braun, M. and Sikdar, N. and Koul, A. and Brix, A.C. and Seisel, S. and Andronescu, C. and Schuhmann, W.
ACS CATALYSIS. Volume: 12 (2022) - 2022 • 469
Highly dispersed Pd clusters/nanoparticles encapsulated in MOFs via in situ auto-reduction method for aqueous phenol hydrogenation
Huang, X. and Li, X. and Xia, W. and Hu, B. and Muhler, M. and Peng, B.
JOURNAL OF MATERIALS SCIENCE AND TECHNOLOGY. Volume: 109 (2022) - 2022 • 468
[NiFe]-(Oxy)Sulfides Derived from NiFe2O4 for the Alkaline Hydrogen Evolution Reaction
Tetzlaff, D. and Alagarasan, V. and Simon, C. and Siegmund, D. and Puring, K.J. and Marschall, R. and Apfel, U.-P.
ENERGIES. Volume: 15 (2022) - 2022 • 467
Laser-equipped gas reaction chamber for probing environmentally sensitive materials at near atomic scale
Khanchandani, H. and El-Zoka, A.A. and Kim, S.-H. and Tezins, U. and Vogel, D. and Sturm, A. and Raabe, D. and Gault, B. and Stephenson, L.T.
PLOS ONE. Volume: 17 (2022) - 2022 • 466
Trapping an Oxidized and Protonated Intermediate of the [FeFe]-Hydrogenase Cofactor under Mildly Reducing Conditions
Senger, M. and Duan, J. and Pavliuk, M.V. and Apfel, U.-P. and Haumann, M. and Stripp, S.T.
INORGANIC CHEMISTRY. Volume: 61 (2022) - 2022 • 465
Non-Classical Conversion of Methanol to Formaldehyde
Deitermann, M. and Huang, Z. and Lechler, S. and Merko, M. and Muhler, M.
CHEMIE-INGENIEUR-TECHNIK. Volume: 94 (2022) - 2022 • 464
Influence of the PTFE Membrane Thickness on the CO2 Electroreduction Performance of Sputtered Cu-PTFE Gas Diffusion Electrodes
Huq, F. and Sanjuán, I. and Baha, S. and Braun, M. and Kostka, A. and Chanda, V. and Junqueira, J.R.C. and Sikdar, N. and Ludwig, A. and Andronescu, C.
CHEMELECTROCHEM. Volume: 9 (2022) - 2022 • 463
Structure-Performance Relationship of LaFe1-xCoxO3 Electrocatalysts for Oxygen Evolution, Isopropanol Oxidation, and Glycerol Oxidation
Brix, A.C. and Dreyer, M. and Koul, A. and Krebs, M. and Rabe, A. and Hagemann, U. and Varhade, S. and Andronescu, C. and Behrens, M. and Schuhmann, W. and Morales, D.M.
CHEMELECTROCHEM. Volume: 9 (2022) - 2022 • 462
Green steel at its crossroads: Hybrid hydrogen-based reduction of iron ores
Souza Filho, I.R. and Springer, H. and Ma, Y. and Mahajan, A. and da Silva, C.C. and Kulse, M. and Raabe, D.
JOURNAL OF CLEANER PRODUCTION. Volume: 340 (2022) - 2022 • 461
Revealing the Heterogeneity of Large-Area MoS2 Layers in the Electrocatalytic Hydrogen Evolution Reaction
Schumacher, S. and Madauß, L. and Liebsch, Y. and Tetteh, E.B. and Varhade, S. and Schuhmann, W. and Schleberger, M. and Andronescu, C.
CHEMELECTROCHEM. Volume: 9 (2022) - 2021 • 460
Nickel nanoparticles supported on nitrogen–doped carbon nanotubes are a highly active, selective and stable CO2 methanation catalyst
Gödde, J. and Merko, M. and Xia, W. and Muhler, M.
JOURNAL OF ENERGY CHEMISTRY. Volume: 54 (2021) - 2021 • 459
Promising Membrane for Polymer Electrolyte Fuel Cells Shows Remarkable Proton Conduction over Wide Temperature and Humidity Ranges
Berber, M.R. and Ismail, M.S. and Pourkashanian, M. and Zakaria Hegazy, M.B. and Apfel, U.-P.
ACS APPLIED POLYMER MATERIALS. Volume: 3 (2021) - 2021 • 458
State-of-the-art progress in the selective photo-oxidation of alcohols
Shen, Z. and Hu, Y. and Li, B. and Zou, Y. and Li, S. and Wilma Busser, G. and Wang, X. and Zhao, G. and Muhler, M.
JOURNAL OF ENERGY CHEMISTRY. Volume: 62 (2021) - 2021 • 457
Stacking fault energy in relation to hydrogen environment embrittlement of metastable austenitic stainless crni‐steels
Fussik, R. and Egels, G. and Theisen, W. and Weber, S.
METALS. Volume: 11 (2021) - 2021 • 456
Chemical heterogeneity enhances hydrogen resistance in high-strength steels
Sun, B. and Lu, W. and Gault, B. and Ding, R. and Makineni, S.K. and Wan, D. and Wu, C.-H. and Chen, H. and Ponge, D. and Raabe, D.
NATURE MATERIALS. Volume: (2021) - 2021 • 455
Efficient electronic passivation scheme for computing low-symmetry compound semiconductor surfaces in density-functional theory slab calculations
Yoo, S.-H. and Lymperakis, L. and Neugebauer, J.
PHYSICAL REVIEW MATERIALS. Volume: 5 (2021) - 2021 • 454
Multi-wall carbon nanotubes electrochemically modified with phosphorus and nitrogen functionalities as a basis for bioelectrodes with improved performance
Quintero-Jaime, A.F. and Conzuelo, F. and Schuhmann, W. and Cazorla-Amorós, D. and Morallón, E.
ELECTROCHIMICA ACTA. Volume: 387 (2021) - 2021 • 453
Insights into lithium manganese oxide-water interfaces using machine learning potentials
Eckhoff, M. and Behler, J.
JOURNAL OF CHEMICAL PHYSICS. Volume: 155 (2021) - 2021 • 452
A bioinspired oxoiron(iv) motif supported on a N2S2macrocyclic ligand
Deutscher, J. and Gerschel, P. and Warm, K. and Kuhlmann, U. and Mebs, S. and Haumann, M. and Dau, H. and Hildebrandt, P. and Apfel, U.-P. and Ray, K.
CHEMICAL COMMUNICATIONS. Volume: 57 (2021) - 2021 • 451
Fe/Co and Ni/Co-pentlandite type electrocatalysts for the hydrogen evolution reaction
Smialkowski, M. and Tetzlaff, D. and Hensgen, L. and Siegmund, D. and Apfel, U.-P.
CHINESE JOURNAL OF CATALYSIS. Volume: 42 (2021) - 2021 • 450
Real-Time Measurement of Cellobiose and Glucose Formation during Enzymatic Biomass Hydrolysis
Chang, H. and Wohlschlager, L. and Csarman, F. and Ruff, A. and Schuhmann, W. and Scheiblbrandner, S. and Ludwig, R.
ANALYTICAL CHEMISTRY. Volume: 93 (2021) - 2021 • 449
Novel approach to study diffusion of hydrogen bearing species in silicate glasses at low temperatures
Bissbort, T. and Becker, H.-W. and Fanara, S. and Chakraborty, S.
CHEMICAL GEOLOGY. Volume: 562 (2021) - 2021 • 448
Site-selective protonation of the one-electron reduced cofactor in [FeFe]-hydrogenase
Laun, K. and Baranova, I. and Duan, J. and Kertess, L. and Wittkamp, F. and Apfel, U.-P. and Happe, T. and Senger, M. and Stripp, S.T.
DALTON TRANSACTIONS. Volume: 50 (2021) - 2021 • 447
Role of pH in the synthesis and growth of gold nanoparticles using L-asparagine: A combined experimental and simulation study
Baez-Cruz, R. and Baptista, L.A. and Ntim, S. and Manidurai, P. and Espinoza, S. and Ramanan, C. and Cortes-Huerto, R. and Sulpizi, M.
JOURNAL OF PHYSICS CONDENSED MATTER. Volume: 33 (2021) - 2021 • 446
Flexibilization of Biorefineries: Tuning Lignin Hydrogenation by Hydrogen Partial Pressure
Cao, Z. and Xu, Y. and Lyu, P. and Dierks, M. and Morales-García, Á. and Schrader, W. and Nachtigall, P. and Schüth, F.
CHEMSUSCHEM. Volume: 14 (2021) - 2021 • 445
A safety cap protects hydrogenase from oxygen attack
Winkler, M. and Duan, J. and Rutz, A. and Felbek, C. and Scholtysek, L. and Lampret, O. and Jaenecke, J. and Apfel, U.-P. and Gilardi, G. and Valetti, F. and Fourmond, V. and Hofmann, E. and Léger, C. and Happe, T.
NATURE COMMUNICATIONS. Volume: 12 (2021) - 2021 • 444
Selective Electrochemical Oxidation of H2O to H2O2Using Boron-Doped Diamond: An Experimental and Techno-Economic Evaluation
Wenderich, K. and Nieuweweme, B.A.M. and Mul, G. and Mei, B.T.
ACS SUSTAINABLE CHEMISTRY AND ENGINEERING. Volume: 9 (2021) - 2021 • 443
Probing the Local Reaction Environment During High Turnover Carbon Dioxide Reduction with Ag-Based Gas Diffusion Electrodes
Dieckhöfer, S. and Öhl, D. and Junqueira, J.R.C. and Quast, T. and Turek, T. and Schuhmann, W.
CHEMISTRY - A EUROPEAN JOURNAL. Volume: 27 (2021) - 2021 • 442
Synergistic Electrocatalytic Hydrogen Evolution in Ni/NiS Nanoparticles Wrapped in Multi-Heteroatom-Doped Reduced Graphene Oxide Nanosheets
Hegazy, M.B.Z. and Berber, M.R. and Yamauchi, Y. and Pakdel, A. and Cao, R. and Apfel, U.-P.
ACS APPLIED MATERIALS AND INTERFACES. Volume: 13 (2021) - 2021 • 441
-Hydrogenases: Maturation and reactivity of enzymatic systems and overview of biomimetic models
Kleinhaus, J.T. and Wittkamp, F. and Yadav, S. and Siegmund, D. and Apfel, U.-P.
CHEMICAL SOCIETY REVIEWS. Volume: 50 (2021) - 2021 • 440
Stripping away ion hydration shells in electrical double-layer formation: Water networks matter
Alfarano, S.R. and Pezzotti, S. and Stein, C.J. and Lin, Z. and Sebastiani, F. and Funke, S. and Hoberg, C. and Kolling, I. and Ma, C.Y. and Mauelshagen, K. and Ockelmann, T. and Schwaab, G. and Fu, L. and Brubach, J.-B. and Roy, P. and Head-Gordon, M. and Tschulik, K. and Gaigeot, M.-P. and Havenith, M.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA. Volume: 118 (2021) - 2021 • 439
Mo-doped ZnV2O6/reduced graphene oxide photoanodes for solar hydrogen production
Sameie, H. and Alvani, A.A.S. and Mei, B.T. and Salimi, R. and Poelman, D. and Rosei, F.
ELECTROCHIMICA ACTA. Volume: 382 (2021) - 2021 • 438
Comparative study of hydrogen embrittlement resistance between additively and conventionally manufactured 304L austenitic stainless steels
Lee, D.-H. and Sun, B. and Lee, S. and Ponge, D. and Jägle, E.A. and Raabe, D.
MATERIALS SCIENCE AND ENGINEERING A. Volume: 803 (2021) - 2021 • 437
Influence of microstructure and atomic-scale chemistry on the direct reduction of iron ore with hydrogen at 700°C
Kim, S.-H. and Zhang, X. and Ma, Y. and Souza Filho, I.R. and Schweinar, K. and Angenendt, K. and Vogel, D. and Stephenson, L.T. and El-Zoka, A.A. and Mianroodi, J.R. and Rohwerder, M. and Gault, B. and Raabe, D.
ACTA MATERIALIA. Volume: 212 (2021) - 2021 • 436
Toward electrocatalytic chemoenzymatic hydrogen evolution and beyond
Prechtl, M.H.G. and Apfel, U.-P.
CELL REPORTS PHYSICAL SCIENCE. Volume: 2 (2021) - 2021 • 435
Sustainable steel through hydrogen plasma reduction of iron ore: Process, kinetics, microstructure, chemistry
Souza Filho, I.R. and Ma, Y. and Kulse, M. and Ponge, D. and Gault, B. and Springer, H. and Raabe, D.
ACTA MATERIALIA. Volume: 213 (2021) - 2021 • 434
Atomic-Precision Tailoring of Au–Ag Core–Shell Composite Nanoparticles for Direct Electrochemical-Plasmonic Hydrogen Evolution in Water Splitting
Mo, J. and Barbosa, E.C.M. and Wu, S. and Li, Y. and Sun, Y. and Xiang, W. and Li, T. and Pu, S. and Robertson, A. and Wu, T.-S. and Soo, Y.-L. and Alves, T.V. and Camargo, P.H.C. and Kuo, W. and Tsang, S.C.E.
ADVANCED FUNCTIONAL MATERIALS. Volume: (2021) - 2021 • 433
Magnetoelectric Tuning of Pinning-Type Permanent Magnets through Atomic-Scale Engineering of Grain Boundaries
Ye, X. and Yan, F. and Schäfer, L. and Wang, D. and Geßwein, H. and Wang, W. and Chellali, M.R. and Stephenson, L.T. and Skokov, K. and Gutfleisch, O. and Raabe, D. and Hahn, H. and Gault, B. and Kruk, R.
ADVANCED MATERIALS. Volume: 33 (2021) - 2021 • 432
CrOx-Mediated Performance Enhancement of Ni/NiO-Mg:SrTiO3in Photocatalytic Water Splitting
Han, K. and Haiber, D.M. and Knöppel, J. and Lievens, C. and Cherevko, S. and Crozier, P. and Mul, G. and Mei, B.
ACS CATALYSIS. Volume: 11 (2021) - 2021 • 431
Searching novel complex solid solution electrocatalysts in unconventional element combinations
Krysiak, O.A. and Schumacher, S. and Savan, A. and Schuhmann, W. and Ludwig, A. and Andronescu, C.
NANO RESEARCH. Volume: (2021) - 2021 • 430
Rapid Interchangeable Hydrogen, Hydride, and Proton Species at the Interface of Transition Metal Atom on Oxide Surface
Wu, S. and Tseng, K.-Y. and Kato, R. and Wu, T.-S. and Large, A. and Peng, Y.-K. and Xiang, W. and Fang, H. and Mo, J. and Wilkinson, I. and Soo, Y.-L. and Held, G. and Suenaga, K. and Li, T. and Chen, H.-Y.T. and Tsang, S.C.E.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 143 (2021) - 2021 • 429
Highly Ordered Mesoporous Co3O4 Electrocatalyst for Efficient, Selective, and Stable Oxidation of 5-Hydroxymethylfurfural to 2,5-Furandicarboxylic Acid
Wang, C. and Bongard, H.-J. and Yu, M. and Schüth, F.
CHEMSUSCHEM. Volume: (2021) - 2021 • 428
The Role of Nitrogen-doping in the Catalytic Transfer Hydrogenation of Phenol to Cyclohexanone with Formic Acid over Pd supported on Carbon Nanotubes
Hu, B. and Li, X. and Busser, W. and Schmidt, S. and Xia, W. and Li, G. and Li, X. and Peng, B.
CHEMISTRY - A EUROPEAN JOURNAL. Volume: 27 (2021) - 2021 • 427
Electrocatalytic Oxidation of Glycerol Using Solid-State Synthesised Nickel Boride: Impact of Key Electrolysis Parameters on Product Selectivity
Brix, A.C. and Morales, D.M. and Braun, M. and Jambrec, D. and Junqueira, J.R.C. and Cychy, S. and Seisel, S. and Masa, J. and Muhler, M. and Andronescu, C. and Schuhmann, W.
CHEMELECTROCHEM. Volume: 8 (2021) - 2021 • 426
Highly Efficient and Selective Aerobic Oxidation of Cinnamyl Alcohol under Visible Light over Pt-Loaded NaNbO3Enriched with Oxygen Vacancies by Ni Doping
Zhao, G. and Bonke, S.A. and Schmidt, S. and Wang, Z. and Hu, B. and Falk, T. and Hu, Y. and Rath, T. and Xia, W. and Peng, B. and Schnegg, A. and Weng, Y. and Muhler, M.
ACS SUSTAINABLE CHEMISTRY AND ENGINEERING. Volume: 9 (2021) - 2021 • 425
A Tandem Solar Biofuel Cell: Harnessing Energy from Light and Biofuels
Riedel, M. and Höfs, S. and Ruff, A. and Schuhmann, W. and Lisdat, F.
ANGEWANDTE CHEMIE - INTERNATIONAL EDITION. Volume: 60 (2021) - 2021 • 424
In situ nanoindentation during electrochemical hydrogen charging: a comparison between front-side and a novel back-side charging approach
Duarte, M.J. and Fang, X. and Rao, J. and Krieger, W. and Brinckmann, S. and Dehm, G.
JOURNAL OF MATERIALS SCIENCE. Volume: 56 (2021) - 2021 • 423
Metal–Organic-Framework-Supported Molecular Electrocatalysis for the Oxygen Reduction Reaction
Liang, Z. and Guo, H. and Zhou, G. and Guo, K. and Wang, B. and Lei, H. and Zhang, W. and Zheng, H. and Apfel, U.-P. and Cao, R.
ANGEWANDTE CHEMIE - INTERNATIONAL EDITION. Volume: 60 (2021) - 2021 • 422
Influence of the Fe : Ni Ratio in FexNi9-xS8 (x=3–6) on the CO2 Electroreduction
Tetzlaff, D. and Pellumbi, K. and Puring, K.J. and Siegmund, D. and Polet, W.S.K. and Checinski, M.P. and Apfel, U.-P.
CHEMELECTROCHEM. Volume: 8 (2021) - 2020 • 421
Accurate Global Potential Energy Surfaces for the H + CH3OH Reaction by Neural Network Fitting with Permutation Invariance
Lu, D. and Behler, J. and Li, J.
JOURNAL OF PHYSICAL CHEMISTRY A. Volume: 124 (2020) - 2020 • 420
A strong and ductile medium-entropy alloy resists hydrogen embrittlement and corrosion
Luo, H. and Sohn, S.S. and Lu, W. and Li, L. and Li, X. and Soundararajan, C.K. and Krieger, W. and Li, Z. and Raabe, D.
NATURE COMMUNICATIONS. Volume: 11 (2020) - 2020 • 419
Identifying the nature of the active sites in methanol synthesis over Cu/ZnO/Al2O3 catalysts
Laudenschleger, D. and Ruland, H. and Muhler, M.
NATURE COMMUNICATIONS. Volume: 11 (2020) - 2020 • 418
Anchoring of palladium nanoparticles on N-doped mesoporous carbon
Warczinski, L. and Hu, B. and Eckhard, T. and Peng, B. and Muhler, M. and Hättig, C.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS. Volume: 22 (2020) - 2020 • 417
Assessing the Influence of Supercritical Carbon Dioxide on the Electrochemical Reduction to Formic Acid Using Carbon-Supported Copper Catalysts
Junge Puring, K. and Evers, O. and Prokein, M. and Siegmund, D. and Scholten, F. and Mölders, N. and Renner, M. and Roldan Cuenya, B. and Petermann, M. and Weidner, E. and Apfel, U.-P.
ACS CATALYSIS. Volume: 10 (2020) - 2020 • 416
Homolytic versus Heterolytic Hydrogen Evolution Reaction Steered by a Steric Effect
Guo, X. and Wang, N. and Li, X. and Zhang, Z. and Zhao, J. and Ren, W. and Ding, S. and Xu, G. and Li, J. and Apfel, U.-P. and Zhang, W. and Cao, R.
ANGEWANDTE CHEMIE - INTERNATIONAL EDITION. Volume: 59 (2020) - 2020 • 415
New phosphorous-based [fefe]-hydrogenase models
Wittkamp, F. and Boydas, E.B. and Roemelt, M. and Apfel, U.-P.
CATALYSTS. Volume: 10 (2020) - 2020 • 414
Structural evolution of bimetallic Co-Cu catalysts in CO hydrogenation to higher alcohols at high pressure
Göbel, C. and Schmidt, S. and Froese, C. and Fu, Q. and Chen, Y.-T. and Pan, Q. and Muhler, M.
JOURNAL OF CATALYSIS. Volume: 383 (2020) - 2020 • 413
Confinement of a three-dimensional organic molecule to two dimensions on a surface
Müller, M. and Henzl, J. and Morgenstern, K.
CHEMICAL PHYSICS LETTERS. Volume: 738 (2020) - 2020 • 412
Structural and photoelectrochemical properties in the thin film system Cu-Fe-V-O and its ternary subsystems Fe-V-O and Cu-V-O
Kumari, S. and Junqueira, J.R.C. and Sarker, S. and Mehta, A. and Schuhmann, W. and Ludwig, Al.
JOURNAL OF CHEMICAL PHYSICS. Volume: 153 (2020) - 2020 • 411
Dependence of hydrogen embrittlement mechanisms on microstructure-driven hydrogen distribution in medium Mn steels
Sun, B. and Krieger, W. and Rohwerder, M. and Ponge, D. and Raabe, D.
ACTA MATERIALIA. Volume: 183 (2020) - 2020 • 410
Hierarchical highly ordered SnO2 nanobowl branched ZnO nanowires for ultrasensitive and selective hydrogen sulfide gas sensing
Zhu, L.-Y. and Yuan, K.-P. and Yang, J.-H. and Hang, C.-Z. and Ma, H.-P. and Ji, X.-M. and Devi, A. and Lu, H.-L. and Zhang, D.W.
MICROSYSTEMS AND NANOENGINEERING. Volume: 6 (2020) - 2020 • 409
Industrial feasibility of anodic hydrogen peroxide production through photoelectrochemical water splitting: a techno-economic analysis
Wenderich, K. and Kwak, W. and Grimm, A. and Kramer, G.J. and Mul, G. and Mei, B.
SUSTAINABLE ENERGY AND FUELS. Volume: 4 (2020) - 2020 • 408
Mechanochemical Cyclodehydrogenation with Elemental Copper: An Alternative Pathway toward Nanographenes
Grätz, S. and Oltermann, M. and Vogt, C.G. and Borchardt, L.
ACS SUSTAINABLE CHEMISTRY AND ENGINEERING. Volume: 8 (2020) - 2020 • 407
Determination of plasma parameters by spectral line broadening in an electrosurgical argon plasma
Hillebrand, B. and Iglesias, E. and Gibson, A.R. and Bibinov, N. and Neugebauer, A. and Enderle, M. and Awakowicz, P.
PLASMA SOURCES SCIENCE AND TECHNOLOGY. Volume: 29 (2020) - 2020 • 406
Electroenzymatic CO2 Fixation Using Redox Polymer/Enzyme-Modified Gas Diffusion Electrodes
Szczesny, J. and Ruff, A. and Oliveira, A.R. and Pita, M. and Pereira, I.A.C. and De Lacey, A.L. and Schuhmann, W.
ACS ENERGY LETTERS. Volume: 5 (2020) - 2020 • 405
Synergistic Effect of Molybdenum and Tungsten in Highly Mixed Carbide Nanoparticles as Effective Catalysts in the Hydrogen Evolution Reaction under Alkaline and Acidic Conditions
Fu, Q. and Peng, B. and Masa, J. and Chen, Y.-T. and Xia, W. and Schuhmann, W. and Muhler, M.
CHEMELECTROCHEM. Volume: 7 (2020) - 2020 • 404
Hydrogen resistance of a 1 GPa strong equiatomic CoCrNi medium entropy alloy
Soundararajan, C.K. and Luo, H. and Raabe, D. and Li, Z.
CORROSION SCIENCE. Volume: 167 (2020) - 2020 • 403
The steady-state kinetics of CO hydrogenation to higher alcohols over a bulk Co-Cu catalyst
Göbel, C. and Schmidt, S. and Froese, C. and Bujara, T. and Viktor Scherer and Muhler, M.
JOURNAL OF CATALYSIS. Volume: (2020) - 2020 • 402
Hydrogen embrittlement at cleavage planes and grain boundaries in bcc iron—revisiting the first-principles cohesive zone model
Guzmán, A.A. and Jeon, J. and Hartmaier, A. and Janisch, R.
MATERIALS. Volume: 13 (2020) - 2020 • 401
Comparative proteomic analysis of osteogenic differentiated human adipose tissue and bone marrow-derived stromal cells
Dadras, M. and May, C. and Wagner, J.M. and Wallner, C. and Becerikli, M. and Dittfeld, S. and Serschnitzki, B. and Schilde, L. and Guntermann, A. and Sengstock, C. and Köller, M. and Seybold, D. and Geßmann, J. and Schildhauer, T.A. and Lehnhardt, M. and Marcus, K. and Behr, B.
JOURNAL OF CELLULAR AND MOLECULAR MEDICINE. Volume: 24 (2020) - 2020 • 400
Can small polyaromatics describe their larger counterparts for local reactions? A computational study on the H-abstraction reaction by an H-atom from polyaromatics
Yonder, Ö. and Schmitz, G. and Hättig, C. and Schmid, R. and Debiagi, P. and Hasse, C. and Locaspi, A. and Faravelli, T.
JOURNAL OF PHYSICAL CHEMISTRY A. Volume: 124 (2020) - 2020 • 399
Shedding Light on Proton and Electron Dynamics in [FeFe] Hydrogenases
Lorent, C. and Katz, S. and Duan, J. and Kulka, C.J. and Caserta, G. and Teutloff, C. and Yadav, S. and Apfel, U.-P. and Winkler, M. and Happe, T. and Horch, M. and Zebger, I.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 142 (2020) - 2020 • 398
A dinuclear porphyrin-macrocycle as efficient catalyst for the hydrogen evolution reaction
Jökel, J. and Schwer, F. and Von Delius, M. and Apfel, U.-P.
CHEMICAL COMMUNICATIONS. Volume: 56 (2020) - 2020 • 397
Nanosecond pulsed discharges in distilled water-Part II: Line emission and plasma propagation
Von Keudell, A. and Grosse, K. and Schulz-Von Der Gathen, V.
PLASMA SOURCES SCIENCE AND TECHNOLOGY. Volume: 29 (2020) - 2020 • 396
Electrochemical dealloying as a tool to tune the porosity, composition and catalytic activity of nanomaterials
Rurainsky, C. and Manjón, A.G. and Hiege, F. and Chen, Y.-T. and Scheu, C. and Tschulik, K.
JOURNAL OF MATERIALS CHEMISTRY A. Volume: 8 (2020) - 2020 • 395
Electrochemical CO2 Reduction-The Effect of Chalcogenide Exchange in Ni-Isocyclam Complexes
Gerschel, P. and Battistella, B. and Siegmund, D. and Ray, K. and Apfel, U.-P.
ORGANOMETALLICS. Volume: 39 (2020) - 2020 • 394
Electrochemical CO2 and Proton Reduction by a Co(dithiacyclam) Complex
Iffland, L. and Siegmund, D. and Apfel, U.-P.
ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE. Volume: 646 (2020) - 2020 • 393
Solute hydrogen and deuterium observed at the near atomic scale in high-strength steel
Breen, A.J. and Stephenson, L.T. and Sun, B. and Li, Y. and Kasian, O. and Raabe, D. and Herbig, M. and Gault, B.
ACTA MATERIALIA. Volume: 188 (2020) - 2020 • 392
CO2 Hydrogenation with Cu/ZnO/Al2O3: A Benchmark Study
Ruland, H. and Song, H. and Laudenschleger, D. and Stürmer, S. and Schmidt, S. and He, J. and Kähler, K. and Muhler, M. and Schlögl, R.
CHEMCATCHEM. Volume: 12 (2020) - 2020 • 391
Water-Soluble Polymers with Appending Porphyrins as Bioinspired Catalysts for the Hydrogen Evolution Reaction
Xie, L. and Tian, J. and Ouyang, Y. and Guo, X. and Zhang, W. and Apfel, U.-P. and Zhang, W. and Cao, R.
ANGEWANDTE CHEMIE - INTERNATIONAL EDITION. Volume: 59 (2020) - 2020 • 390
Photocatalytic hydrogen production by photo-reforming of methanol with one-pot synthesized Pt-containing TiO2 photocatalysts
Chung, Y.-H. and Han, K. and Lin, C.-Y. and O'Neill, D. and Mul, G. and Mei, B. and Yang, C.-M.
CATALYSIS TODAY. Volume: 356 (2020) - 2020 • 389
Formic Acid-Assisted Selective Hydrogenolysis of 5-Hydroxymethylfurfural to 2,5-Dimethylfuran over Bifunctional Pd Nanoparticles Supported on N-Doped Mesoporous Carbon
Hu, B. and Warczinski, L. and Li, X. and Lu, M. and Bitzer, J. and Heidelmann, M. and Eckhard, T. and Fu, Q. and Schulwitz, J. and Merko, M. and Li, M. and Kleist, W. and Hättig, C. and Muhler, M. and Peng, B.
ANGEWANDTE CHEMIE - INTERNATIONAL EDITION. Volume: (2020) - 2020 • 388
Redox-Polymer-Wired [NiFeSe] Hydrogenase Variants with Enhanced O2 Stability for Triple-Protected High-Current-Density H2-Oxidation Bioanodes
Ruff, A. and Szczesny, J. and Vega, M. and Zacarias, S. and Matias, P.M. and Gounel, S. and Mano, N. and Pereira, I.A.C. and Schuhmann, W.
CHEMSUSCHEM. Volume: 13 (2020) - 2020 • 387
Redox-Polymer-Based High-Current-Density Gas-Diffusion H2-Oxidation Bioanode Using [FeFe] Hydrogenase from Desulfovibrio desulfuricans in a Membrane-free Biofuel Cell
Szczesny, J. and Birrell, J.A. and Conzuelo, F. and Lubitz, W. and Ruff, A. and Schuhmann, W.
ANGEWANDTE CHEMIE - INTERNATIONAL EDITION. Volume: 59 (2020) - 2020 • 386
Morphology, microstructure, coordinative unsaturation, and hydrogenation activity of unsupported MoS2: How idealized models fail to describe a real sulfide material
Bekx-Schürmann, S. and Mangelsen, S. and Breuninger, P. and Antoni, H. and Schürmann, U. and Kienle, L. and Muhler, M. and Bensch, W. and Grünert, W.
APPLIED CATALYSIS B: ENVIRONMENTAL. Volume: 266 (2020) - 2020 • 385
Metal-Rich Chalcogenides for Electrocatalytic Hydrogen Evolution: Activity of Electrodes and Bulk Materials
Siegmund, D. and Blanc, N. and Smialkowski, M. and Tschulik, K. and Apfel, U.-P.
CHEMELECTROCHEM. Volume: 7 (2020) - 2019 • 384
Ni-Metalloid (B, Si, P, As, and Te) Alloys as Water Oxidation Electrocatalysts
Masa, J. and Piontek, S. and Wilde, P. and Antoni, H. and Eckhard, T. and Chen, Y.-T. and Muhler, M. and Apfel, U.-P. and Schuhmann, W.
ADVANCED ENERGY MATERIALS. Volume: 9 (2019) - 2019 • 383
How [FeFe]-Hydrogenase Facilitates Bidirectional Proton Transfer
Senger, M. and Eichmann, V. and Laun, K. and Duan, J. and Wittkamp, F. and Knör, G. and Apfel, U.-P. and Happe, T. and Winkler, M. and Heberle, J. and Stripp, S.T.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 141 (2019) - 2019 • 382
Structure and Dynamics of the Liquid-Water/Zinc-Oxide Interface from Machine Learning Potential Simulations
Quaranta, V. and Behler, J. and Hellström, M.
JOURNAL OF PHYSICAL CHEMISTRY C. Volume: 123 (2019) - 2019 • 381
Direct Growth of Highly Strained Pt Islands on Branched Ni Nanoparticles for Improved Hydrogen Evolution Reaction Activity
Alinezhad, A. and Gloag, L. and Benedetti, T.M. and Cheong, S. and Webster, R.F. and Roelsgaard, M. and Iversen, B.B. and Schuhmann, W. and Gooding, J.J. and Tilley, R.D.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 141 (2019) - 2019 • 380
Ti and its alloys as examples of cryogenic focused ion beam milling of environmentally-sensitive materials
Chang, Y. and Lu, W. and Guénolé, J. and Stephenson, L.T. and Szczpaniak, A. and Kontis, P. and Ackerman, A.K. and Dear, F.F. and Mouton, I. and Zhong, X. and Zhang, S. and Dye, D. and Liebscher, C.H. and Ponge, D. and Korte-Kerzel, S. and Raabe, D. and Gault, B.
NATURE COMMUNICATIONS. Volume: 10 (2019) - 2019 • 379
New Insights into the Catalytic Activity of Cobalt Orthophosphate Co3(PO4)2 from Charge Density Analysis
Keil, H. and Hellström, M. and Stückl, C. and Herbst-Irmer, R. and Behler, J. and Stalke, D.
CHEMISTRY - A EUROPEAN JOURNAL. Volume: 25 (2019) - 2019 • 378
Ab initio thermodynamics of liquid and solid water
Cheng, B. and Engel, E.A. and Behler, J. and Dellago, C. and Ceriotti, M.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA. Volume: 116 (2019) - 2019 • 377
The kinetics of glycerol hydrodeoxygenation to 1,2-propanediol over Cu/ZrO2 in the aqueous phase
Gabrysch, T. and Muhler, M. and Peng, B.
APPLIED CATALYSIS A: GENERAL. Volume: 576 (2019) - 2019 • 376
Correlating the short-time current response of a hydrogen evolving nickel electrode to bubble growth
Pande, N. and Mul, G. and Lohse, D. and Mei, B.
JOURNAL OF THE ELECTROCHEMICAL SOCIETY. Volume: 166 (2019) - 2019 • 375
Catalytic Reactivation of Industrial Oxygen Depolarized Cathodes by in situ Generation of Atomic Hydrogen
Öhl, D. and Franzen, D. and Paulisch, M. and Dieckhöfer, S. and Barwe, S. and Andronescu, C. and Manke, I. and Turek, T. and Schuhmann, W.
CHEMSUSCHEM. Volume: 12 (2019) - 2019 • 374
The kinetics of glycerol hydrodeoxygenation to 1,2-propanediol over Cu/ZrO 2 in the aqueous phase
Gabrysch, T. and Muhler, M. and Peng, B.
APPLIED CATALYSIS A: GENERAL. Volume: (2019) - 2019 • 373
Role of surface oxide layers in the hydrogen embrittlement of austenitic stainless steels: A TOF-SIMS study
Izawa, C. and Wagner, S. and Deutges, M. and Martín, M. and Weber, S. and Pargeter, R. and Michler, T. and Uchida, H.-H. and Gemma, R. and Pundt, A.
ACTA MATERIALIA. Volume: 180 (2019) - 2019 • 372
Seleno-analogues of pentlandites (Fe4.5Ni4.5S8-: YSey, y = 1-6): Tuning bulk Fe/Ni sulphoselenides for hydrogen evolution
Smialkowski, M. and Siegmund, D. and Pellumbi, K. and Hensgen, L. and Antoni, H. and Muhler, M. and Apfel, U.-P.
CHEMICAL COMMUNICATIONS. Volume: 55 (2019) - 2019 • 371
Oxygen vacancies and hydrogen doping in LaAlO3/SrTiO3 heterostructures: Electronic properties and impact on surface and interface reconstruction
Piyanzina, I.I. and Eyert, V. and Lysogorskiy, Yu.V. and Tayurskii, D.A. and Kopp, T.
JOURNAL OF PHYSICS CONDENSED MATTER. Volume: 31 (2019) - 2019 • 370
Density functional theory calculations of iron - vanadium carbide interfaces and the effect of hydrogen
Echeverri Restrepo, S. and Di Stefano, D. and Mrovec, M. and Paxton, A.T.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY. Volume: (2019) - 2019 • 369
Geometry of the Catalytic Active Site in [FeFe]-Hydrogenase Is Determined by Hydrogen Bonding and Proton Transfer
Duan, J. and Mebs, S. and Laun, K. and Wittkamp, F. and Heberle, J. and Happe, T. and Hofmann, E. and Apfel, U.-P. and Winkler, M. and Senger, M. and Haumann, M. and Stripp, S.T.
ACS CATALYSIS. Volume: 9 (2019) - 2019 • 368
Heterogeneous Interactions between Gas-Phase Pyruvic Acid and Hydroxylated Silica Surfaces: A Combined Experimental and Theoretical Study
Fang, Y. and Lesnicki, D. and Wall, K.J. and Gaigeot, M.-P. and Sulpizi, M. and Vaida, V. and Grassian, V.H.
JOURNAL OF PHYSICAL CHEMISTRY A. Volume: 123 (2019) - 2019 • 367
Tailoring the Surface Structure of Silicon Carbide Support for Copper Catalyzed Ethanol Dehydrogenation
Li, M.-Y. and Lu, W.-D. and He, L. and Schüth, F. and Lu, A.-H.
CHEMCATCHEM. Volume: 11 (2019) - 2019 • 366
Differential Protonation at the Catalytic Six-Iron Cofactor of [FeFe]-Hydrogenases Revealed by 57 Fe Nuclear Resonance X-ray Scattering and Quantum Mechanics/Molecular Mechanics Analyses
Mebs, S. and Duan, J. and Wittkamp, F. and Stripp, S.T. and Happe, T. and Apfel, U.-P. and Winkler, M. and Haumann, M.
INORGANIC CHEMISTRY. Volume: (2019) - 2019 • 365
On the role of nitrogen on hydrogen environment embrittlement of high-interstitial austenitic CrMnC(N) steels
Egels, G. and Fussik, R. and Weber, S. and Theisen, W.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY. Volume: 44 (2019) - 2019 • 364
Quantification of solute deuterium in titanium deuteride by atom probe tomography with both laser pulsing and high-voltage pulsing: Influence of the surface electric field
Chang, Y.H. and Mouton, I. and Stephenson, L. and Ashton, M. and Zhang, G.K. and Szczpaniak, A. and Lu, W.J. and Ponge, D. and Raabe, D. and Gault, B.
NEW JOURNAL OF PHYSICS. Volume: 21 (2019) - 2019 • 363
Comparing pore structure models of nanoporous carbons obtained from small angle X-ray scattering and gas adsorption
Prehal, C. and Grätz, S. and Krüner, B. and Thommes, M. and Borchardt, L. and Presser, V. and Paris, O.
CARBON. Volume: 152 (2019) - 2019 • 362
Selective 2-Propanol Oxidation over Unsupported Co3O4 Spinel Nanoparticles: Mechanistic Insights into Aerobic Oxidation of Alcohols
Anke, S. and Bendt, G. and Sinev, I. and Hajiyani, H. and Antoni, H. and Zegkinoglou, I. and Jeon, H. and Pentcheva, R. and Roldan Cuenya, B. and Schulz, S. and Muhler, M.
ACS CATALYSIS. Volume: 9 (2019) - 2019 • 361
Quantification Challenges for Atom Probe Tomography of Hydrogen and Deuterium in Zircaloy-4
Mouton, I. and Breen, A.J. and Wang, S. and Chang, Y. and Szczepaniak, A. and Kontis, P. and Stephenson, L.T. and Raabe, D. and Herbig, M. and Britton, T.B. and Gault, B.
MICROSCOPY AND MICROANALYSIS. Volume: 25 (2019) - 2019 • 360
Micromechanical modelling of coupled crystal plasticity and hydrogen diffusion
Hassan, H.U. and Govind, K. and Hartmaier, A.
PHILOSOPHICAL MAGAZINE. Volume: 99 (2019) - 2019 • 359
Atomic-scale investigation of hydrogen distribution in a Ti–Mo alloy
Yan, F. and Mouton, I. and Stephenson, L.T. and Breen, A.J. and Chang, Y. and Ponge, D. and Raabe, D. and Gault, B.
SCRIPTA MATERIALIA. Volume: 162 (2019) - 2019 • 358
Relationship between hydrogen embrittlement and Md30 temperature: Prediction of low-nickel austenitic stainless steel's resistance
Izawa, C. and Wagner, S. and Deutges, M. and Martín, M. and Weber, S. and Pargeter, R. and Michler, T. and Uchida, H.-H. and Gemma, R. and Pundt, A.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY. Volume: 44 (2019) - 2019 • 357
Loss of Specific Active-Site Iron Atoms in Oxygen-Exposed [FeFe]-Hydrogenase Determined by Detailed X-ray Structure Analyses
Esselborn, J. and Kertess, L. and Apfel, U.-P. and Hofmann, E. and Happe, T.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 141 (2019) - 2019 • 356
Strength of hydrogen-free and hydrogen-doped Ni50Ti50 shape memory platelets
Weiser, A. and Buršíková, V. and Jarý, M. and Dymáček, P. and Dugáček, J. and Frenzel, J. and Čermák, J. and Dlouhý, A.
SCRIPTA MATERIALIA. Volume: 162 (2019) - 2019 • 355
Strength of hydrogen-free and hydrogen-doped Ni 50 Ti 50 shape memory platelets
Weiser, A. and Buršíková, V. and Jarý, M. and Dymáček, P. and Dugáček, J. and Frenzel, J. and Čermák, J. and Dlouhý, A.
SCRIPTA MATERIALIA. Volume: 162 (2019) - 2019 • 354
Electrochemical formation of Cr(III)-based films on Au electrodes
Smulders, V. and Simic, N. and Gomes, A.S.O. and Mei, B. and Mul, G.
ELECTROCHIMICA ACTA. Volume: 296 (2019) - 2019 • 353
Rare-earth ion exchanged Cu-SSZ-13 zeolite from organotemplate-free synthesis with enhanced hydrothermal stability in NH 3 -SCR of NO : X
Zhao, Z. and Yu, R. and Shi, C. and Gies, H. and Xiao, F.-S. and De Vos, D. and Yokoi, T. and Bao, X. and Kolb, U. and McGuire, R. and Parvulescu, A.-N. and Maurer, S. and Müller, U. and Zhang, W.
CATALYSIS SCIENCE AND TECHNOLOGY. Volume: 9 (2019) - 2019 • 352
Highly Selective Anaerobic Oxidation of Alcohols Over Fe-doped SrTiO3 Under Visible Light
Hu, Y. and Zhao, G. and Pan, Q. and Wang, H. and Shen, Z. and Peng, B. and Busser, G.W. and Wang, X. and Muhler, M.
CHEMCATCHEM. Volume: 11 (2019) - 2019 • 351
Anaerobic Alcohol Conversion to Carbonyl Compounds over Nanoscaled Rh-Doped SrTiO 3 under Visible Light
Zhao, G. and Busser, G.W. and Froese, C. and Hu, B. and Bonke, S.A. and Schnegg, A. and Ai, Y. and Wei, D. and Wang, X. and Peng, B. and Muhler, M.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS. Volume: 10 (2019) - 2019 • 350
PS-PVD Processing of Single-Phase Lanthanum Tungstate Layers for Hydrogen-Related Applications
Marcano, D. and Ivanova, M.E. and Mauer, G. and Sohn, Y.J. and Schwedt, A. and Bram, M. and Menzler, N.H. and Vaßen, R.
JOURNAL OF THERMAL SPRAY TECHNOLOGY. Volume: 28 (2019) - 2019 • 349
Anomalously Low Barrier for Water Dimer Diffusion on Cu(111)
Bertram, C. and Fang, W. and Pedevilla, P. and Michaelides, A. and Morgenstern, K.
NANO LETTERS. Volume: 19 (2019) - 2019 • 348
Nanoporous carbon: Liquid-free synthesis and geometry-dependent catalytic performance
Xu, R. and Kang, L. and Knossalla, J. and Mielby, J. and Wang, Q. and Wang, B. and Feng, J. and He, G. and Qin, Y. and Xie, J. and Swertz, A.-C. and He, Q. and Kegnæs, Sø. and Brett, D.J.L. and Schüth, F. and Wang, F.R.
ACS NANO. Volume: 13 (2019) - 2019 • 347
Photocatalytic one-step synthesis of Ag nanoparticles without reducing agent and their catalytic redox performance supported on carbon
Shui, L. and Zhang, G. and Hu, B. and Chen, X. and Jin, M. and Zhou, G. and Li, N. and Muhler, M. and Peng, B.
JOURNAL OF ENERGY CHEMISTRY. Volume: 36 (2019) - 2019 • 346
Influence of the Nature of Boron-Doped Diamond Anodes on the Dehydrogenative Phenol-Phenol Cross-Coupling
Gleede, B. and Yamamoto, T. and Nakahara, K. and Botz, A. and Graßl, T. and Neuber, R. and Matthée, T. and Einaga, Y. and Schuhmann, W. and Waldvogel, S.R.
CHEMELECTROCHEM. Volume: 6 (2019) - 2019 • 345
Integration of Molybdenum-Doped, Hydrogen-Annealed BiVO 4 with Silicon Microwires for Photoelectrochemical Applications
Milbrat, A. and Vijselaar, W. and Guo, Y. and Mei, B. and Huskens, J. and Mul, G.
ACS SUSTAINABLE CHEMISTRY AND ENGINEERING. Volume: 7 (2019) - 2019 • 344
Direct, Selective Production of Aromatic Alcohols from Ethanol Using a Tailored Bifunctional Cobalt-Hydroxyapatite Catalyst
Wang, Q.-N. and Weng, X.-F. and Zhou, B.-C. and Lv, S.-P. and Miao, S. and Zhang, D. and Han, Y. and Scott, S.L. and Schüth, F. and Lu, A.-H.
ACS CATALYSIS. Volume: 9 (2019) - 2019 • 343
Aggregation control of Ru and Ir nanoparticles by tunable aryl alkyl imidazolium ionic liquids
Schmolke, L. and Lerch, S. and Bülow, M. and Siebels, M. and Schmitz, A. and Thomas, J. and Dehm, G. and Held, C. and Strassner, T. and Janiak, C.
NANOSCALE. Volume: 11 (2019) - 2019 • 342
In situ formed vanadium-oxide cathode coatings for selective hydrogen production
Endrődi, B. and Smulders, V. and Simic, N. and Wildlock, M. and Mul, G. and Mei, B. and Cornell, A.
APPLIED CATALYSIS B: ENVIRONMENTAL. Volume: 244 (2019) - 2019 • 341
Partitioning of interstitial segregants during decohesion: A DFT case study of the ∑3 symmetric tilt grain boundary in ferritic steel
Huang, X. and Janisch, R.
MATERIALS. Volume: 12 (2019) - 2019 • 340
FexNi9-xS8 (x = 3-6) as potential photocatalysts for solar-driven hydrogen production?
Tetzlaff, D. and Simon, C. and Achilleos, D.S. and Smialkowski, M. and Junge Puring, K. and Bloesser, A. and Piontek, S. and Kasap, H. and Siegmund, D. and Reisner, E. and Marschall, R. and Apfel, U.-P.
FARADAY DISCUSSIONS. Volume: 215 (2019) - 2018 • 339
Maximally resolved anharmonic OH vibrational spectrum of the water/ZnO(10 1 0) interface from a high-dimensional neural network potential
Quaranta, V. and Hellström, M. and Behler, J. and Kullgren, J. and Mitev, P.D. and Hermansson, K.
JOURNAL OF CHEMICAL PHYSICS. Volume: 148 (2018) - 2018 • 338
Live cyanobacteria produce photocurrent and hydrogen using both the respiratory and photosynthetic systems
Saper, G. and Kallmann, D. and Conzuelo, F. and Zhao, F. and Tóth, T.N. and Liveanu, V. and Meir, S. and Szymanski, J. and Aharoni, A. and Schuhmann, W. and Rothschild, A. and Schuster, G. and Adir, N.
NATURE COMMUNICATIONS. Volume: 9 (2018) - 2018 • 337
High surface area black TiO2 templated from ordered mesoporous carbon for solar driven hydrogen evolution
Xiong, Y. and Gu, D. and Deng, X. and Tüysüz, H. and van Gastel, M. and Schüth, F. and Marlow, F.
MICROPOROUS AND MESOPOROUS MATERIALS. Volume: 268 (2018) - 2018 • 336
Direct Growth of MoS2 and WS2 Layers by Metal Organic Chemical Vapor Deposition
Cwik, S. and Mitoraj, D. and Mendoza Reyes, O. and Rogalla, D. and Peeters, D. and Kim, J. and Schütz, H.M. and Bock, C. and Beranek, R. and Devi, A.
ADVANCED MATERIALS INTERFACES. Volume: 5 (2018) - 2018 • 335
Nuclear Quantum Effects in Sodium Hydroxide Solutions from Neural Network Molecular Dynamics Simulations
Hellström, M. and Ceriotti, M. and Behler, J.
JOURNAL OF PHYSICAL CHEMISTRY B. Volume: 122 (2018) - 2018 • 334
Rechargeable, flexible and mediator-free biosupercapacitor based on transparent ITO nanoparticle modified electrodes acting in µM glucose containing buffers
Bobrowski, T. and González Arribas, E. and Ludwig, R. and Toscano, M.D. and Shleev, S. and Schuhmann, W.
BIOSENSORS AND BIOELECTRONICS. Volume: 101 (2018) - 2018 • 333
Viologen-modified electrodes for protection of hydrogenases from high potential inactivation while performing H2 oxidation at low overpotential
Oughli, A.A. and Vélez, M. and Birrell, J.A. and Schuhmann, W. and Lubitz, W. and Plumeré, N. and Rüdiger, O.
DALTON TRANSACTIONS. Volume: 47 (2018) - 2018 • 332
Dual properties of a hydrogen oxidation Ni-catalyst entrapped within a polymer promote self-defense against oxygen /639/638/77/886 /639/638/161/893 /639/638/675 /120 /128 /140/131 article
Oughli, A.A. and Ruff, A. and Boralugodage, N.P. and Rodríguez-Maciá, P. and Plumeré, N. and Lubitz, W. and Shaw, W.J. and Schuhmann, W. and Rüdiger, O.
NATURE COMMUNICATIONS. Volume: 9 (2018) - 2018 • 331
Derivation of property distribution images from microstructural analyses of X2CrNi18-9 with regard to hydrogen embrittlement [Ableitung von Eigenschaftsverteilungsbildern aus mikrostrukturellen Analysen des X2CrNi18-9 im Zusammenhang mit der Wasserstoffversprödung]
Fussik, R. and Weber, S.
PRAKTISCHE METALLOGRAPHIE/PRACTICAL METALLOGRAPHY. Volume: 55 (2018) - 2018 • 330
Towards sustainable chlorate production: The effect of permanganate addition on current efficiency
Endrődi, B. and Sandin, S. and Smulders, V. and Simic, N. and Wildlock, M. and Mul, G. and Mei, B.T. and Cornell, A.
JOURNAL OF CLEANER PRODUCTION. Volume: 182 (2018) - 2018 • 329
Light-induced formation of partially reduced oxygen species limits the lifetime of photosystem 1-based biocathodes
Zhao, F. and Hardt, S. and Hartmann, V. and Zhang, H. and Nowaczyk, M.M. and Rögner, M. and Plumeré, N. and Schuhmann, W. and Conzuelo, F.
NATURE COMMUNICATIONS. Volume: 9 (2018) - 2018 • 328
A gas breathing hydrogen/air biofuel cell comprising a redox polymer/hydrogenase-based bioanode
Szczesny, J. and Marković, N. and Conzuelo, F. and Zacarias, S. and Pereira, I.A.C. and Lubitz, W. and Plumeré, N. and Schuhmann, W. and Ruff, A.
NATURE COMMUNICATIONS. Volume: 9 (2018) - 2018 • 327
Multiscale modelling of hydrogen transport and segregation in polycrystalline steels
Hüter, C. and Shanthraj, P. and McEniry, E. and Spatschek, R. and Hickel, T. and Tehranchi, A. and Guo, X. and Roters, F.
METALS. Volume: 8 (2018) - 2018 • 326
Multiscale modeling on biological systems
Sulpizi, M. and Faller, R. and Pantano, S.
BIOCHEMICAL AND BIOPHYSICAL RESEARCH COMMUNICATIONS. Volume: 498 (2018) - 2018 • 325
Ab initio simulation of hydrogen-induced decohesion in cementite-containing microstructures
McEniry, E.J. and Hickel, T. and Neugebauer, J.
ACTA MATERIALIA. Volume: 150 (2018) - 2018 • 324
Copper Supported on Hybrid C@SiO2 Hollow Submicron Spheres as Active Ethanol Dehydrogenation Catalyst
Lu, W.-D. and Wang, Q.-N. and He, L. and Li, W.-C. and Schüth, F. and Lu, A.-H.
CHEMNANOMAT. Volume: 4 (2018) - 2018 • 323
A fully protected hydrogenase/polymer-based bioanode for high-performance hydrogen/glucose biofuel cells
Ruff, A. and Szczesny, J. and Marković, N. and Conzuelo, F. and Zacarias, S. and Pereira, I.A.C. and Lubitz, W. and Schuhmann, W.
NATURE COMMUNICATIONS. Volume: 9 (2018) - 2018 • 322
Oxygen Reduction Activity and Reversible Deactivation of Single Silver Nanoparticles during Particle Adsorption Events
Öhl, D. and Clausmeyer, J. and Barwe, S. and Botz, A. and Schuhmann, W.
CHEMELECTROCHEM. Volume: 5 (2018) - 2018 • 321
Light as Trigger for Biocatalysis: Photonic Wiring of Flavin Adenine Dinucleotide-Dependent Glucose Dehydrogenase to Quantum Dot-Sensitized Inverse Opal TiO2 Architectures via Redox Polymers
Riedel, M. and Parak, W.J. and Ruff, A. and Schuhmann, W. and Lisdat, F.
ACS CATALYSIS. Volume: 8 (2018) - 2018 • 320
Oxygen Evolution Catalysis with Mössbauerite—A Trivalent Iron-Only Layered Double Hydroxide
Ertl, M. and Andronescu, C. and Moir, J. and Zobel, M. and Wagner, F.E. and Barwe, S. and Ozin, G. and Schuhmann, W. and Breu, J.
CHEMISTRY - A EUROPEAN JOURNAL. Volume: 24 (2018) - 2018 • 319
Characterizing solute hydrogen and hydrides in pure and alloyed titanium at the atomic scale
Chang, Y. and Breen, A.J. and Tarzimoghadam, Z. and Kürnsteiner, P. and Gardner, H. and Ackerman, A. and Radecka, A. and Bagot, P.A.J. and Lu, W. and Li, T. and Jägle, E.A. and Herbig, M. and Stephenson, L.T. and Moody, M.P. and Rugg, D. and Dye, D. and Ponge, D. and Raabe, D. and Gault, B.
ACTA MATERIALIA. Volume: 150 (2018) - 2018 • 318
Cu supported on thin carbon layer-coated porous SiO2 for efficient ethanol dehydrogenation
Wang, Q.-N. and Shi, L. and Li, W. and Li, W.-C. and Si, R. and Schüth, F. and Lu, A.-H.
CATALYSIS SCIENCE AND TECHNOLOGY. Volume: 8 (2018) - 2018 • 317
Investigation of the local austenite stability related to hydrogen environment embrittlement of austenitic stainless steels
Fussik, R. and Egels, G. and Theisen, W. and Weber, S.
MATERIALS SCIENCE FORUM. Volume: 941 MSF (2018) - 2018 • 316
From Enzymes to Functional Materials—Towards Activation of Small Molecules
Möller, F. and Piontek, S. and Miller, R.G. and Apfel, U.-P.
CHEMISTRY - A EUROPEAN JOURNAL. Volume: 24 (2018) - 2018 • 315
Hydrogenases: Recent developments and future perspectives
Wittkamp, F. and Senger, M. and Stripp, S.T. and Apfel, U.-P.
CHEMICAL COMMUNICATIONS. Volume: 54 (2018) - 2018 • 314
Crystallographic and spectroscopic assignment of the proton transfer pathway in [FeFe]-hydrogenases
Duan, J. and Senger, M. and Esselborn, J. and Engelbrecht, V. and Wittkamp, F. and Apfel, U.-P. and Hofmann, E. and Stripp, S.T. and Happe, T. and Winkler, M.
NATURE COMMUNICATIONS. Volume: 9 (2018) - 2018 • 313
Oxidation and stability of multi-walled carbon nanotubes in hydrogen peroxide solution
Safo, I.A. and Liu, F. and Xie, K. and Xia, W.
MATERIALS CHEMISTRY AND PHYSICS. Volume: 214 (2018) - 2018 • 312
Hydrogen embrittlement of tungsten induced by deuterium plasma: Insights from nanoindentation tests
Fang, X. and Kreter, A. and Rasinski, M. and Kirchlechner, C. and Brinckmann, S. and Linsmeier, C. and Dehm, G.
JOURNAL OF MATERIALS RESEARCH. Volume: 33 (2018) - 2018 • 311
Analysis of hydrogen diffusion and trapping in ultra-high strength steel grades
Schaffner, T. and Hartmaier, A. and Kokotin, V. and Pohl, M.
JOURNAL OF ALLOYS AND COMPOUNDS. Volume: 746 (2018) - 2018 • 310
Hydrogen embrittlement of an interstitial equimolar high-entropy alloy
Luo, H. and Li, Z. and Lu, W. and Ponge, D. and Raabe, D.
CORROSION SCIENCE. Volume: 136 (2018) - 2018 • 309
Electrochemical stability of hexagonal tungsten carbide in the potential window of fuel cells and water electrolyzers investigated in a half-cell configuration
Göhl, D. and Mingers, A.M. and Geiger, S. and Schalenbach, M. and Cherevko, S. and Knossalla, J. and Jalalpoor, D. and Schüth, F. and Mayrhofer, K.J.J. and Ledendecker, M.
ELECTROCHIMICA ACTA. Volume: 270 (2018) - 2018 • 308
First-Principles Approach to Model Electrochemical Reactions: Understanding the Fundamental Mechanisms behind Mg Corrosion
Surendralal, S. and Todorova, M. and Finnis, M.W. and Neugebauer, J.
PHYSICAL REVIEW LETTERS. Volume: 120 (2018) - 2018 • 307
Hydrogen and oxygen trapping at the H-cluster of [FeFe]-hydrogenase revealed by site-selective spectroscopy and QM/MM calculations
Mebs, S. and Kositzki, R. and Duan, J. and Kertess, L. and Senger, M. and Wittkamp, F. and Apfel, U.-P. and Happe, T. and Stripp, S.T. and Winkler, M. and Haumann, M.
BIOCHIMICA ET BIOPHYSICA ACTA - BIOENERGETICS. Volume: 1859 (2018) - 2018 • 306
On the Ni-Ion release rate from surfaces of binary NiTi shape memory alloys
Ševčíková, J. and Bártková, D. and Goldbergová, M. and Kuběnová, M. and Čermák, J. and Frenzel, J. and Weiser, A. and Dlouhý, A.
APPLIED SURFACE SCIENCE. Volume: 427 (2018) - 2018 • 305
Overcoming cathode poisoning from electrolyte impurities in alkaline electrolysis by means of self-healing electrocatalyst films
Barwe, S. and Mei, B. and Masa, J. and Schuhmann, W. and Ventosa, E.
NANO ENERGY. Volume: 53 (2018) - 2018 • 304
On the nature of spillover hydrogen species on platinum/nitrogen-doped mesoporous carbon composites: A temperature-programmed nitrobenzene desorption study
Yang, F. and Hu, B. and Xia, W. and Peng, B. and Shen, J. and Muhler, M.
JOURNAL OF CATALYSIS. Volume: 365 (2018) - 2018 • 303
H2 quantification based on selective pre-concentration and oxidative stripping at Pd modified microelectrodes
Koster, D. and Gutkowski, R. and Masa, J. and Schuhmann, W.
JOURNAL OF ELECTROANALYTICAL CHEMISTRY. Volume: 812 (2018) - 2018 • 302
Atomic Layer Deposition of Molybdenum and Tungsten Oxide Thin Films Using Heteroleptic Imido-Amidinato Precursors: Process Development, Film Characterization, and Gas Sensing Properties
Mattinen, M. and Wree, J.-L. and Stegmann, N. and Ciftyurek, E. and Achhab, M.E. and King, P.J. and Mizohata, K. and Räisänen, J. and Schierbaum, K.D. and Devi, A. and Ritala, M. and Leskelä, M.
CHEMISTRY OF MATERIALS. Volume: 30 (2018) - 2018 • 301
Protonation/reduction dynamics at the [4Fe-4S] cluster of the hydrogen-forming cofactor in [FeFe]-hydrogenases
Senger, M. and Mebs, S. and Duan, J. and Shulenina, O. and Laun, K. and Kertess, L. and Wittkamp, F. and Apfel, U.-P. and Happe, T. and Winkler, M. and Haumann, M. and Stripp, S.T.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS. Volume: 20 (2018) - 2018 • 300
A Microscopic Interpretation of Pump-Probe Vibrational Spectroscopy Using Ab Initio Molecular Dynamics
Lesnicki, D. and Sulpizi, M.
JOURNAL OF PHYSICAL CHEMISTRY B. Volume: 122 (2018) - 2018 • 299
Impact of chemical inhomogeneities on local material properties and hydrogen environment embrittlement in AISI 304L steels
Egels, G. and Mujica Roncery, L. and Fussik, R. and Theisen, W. and Weber, S.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY. Volume: (2018) - 2018 • 298
Local Surface Structure and Composition Control the Hydrogen Evolution Reaction on Iron Nickel Sulfides
Bentley, C.L. and Andronescu, C. and Smialkowski, M. and Kang, M. and Tarnev, T. and Marler, B. and Unwin, P.R. and Apfel, U.-P. and Schuhmann, W.
ANGEWANDTE CHEMIE - INTERNATIONAL EDITION. Volume: 57 (2018) - 2018 • 297
Pathways to electrochemical solar-hydrogen technologies
Ardo, S. and Fernandez Rivas, D. and Modestino, M.A. and Schulze Greiving, V. and Abdi, F.F. and Alarcon Llado, E. and Artero, V. and Ayers, K. and Battaglia, C. and Becker, J.-P. and Bederak, D. and Berger, A. and Buda, F. and Chinello, E. and Dam, B. and Di Palma, V. and Edvinsson, T. and Fujii, K. and Gardeniers, H. and Geerlings, H. and Hashemi, S.M. and Haussener, S. and Houle, F. and Huskens, J. and James, B.D. and Konrad, K. and Kudo, A. and Kunturu, P.P. and Lohse, D. and Mei, B. and Miller, E.L. and Moore, G.F. and Muller, J. and Orchard, K.L. and Rosser, T.E. and Saadi, F.H. and Schüttauf, J.-W. and Seger, B. and Sheehan, S.W. and Smith, W.A. and Spurgeon, J. and Tang, M.H. and Van De Krol, R. and Vesborg, P.C.K. and Westerik, P.
ENERGY AND ENVIRONMENTAL SCIENCE. Volume: 11 (2018) - 2018 • 296
Influence of the Fe:Ni Ratio and Reaction Temperature on the Efficiency of (FexNi1-x)9S8 Electrocatalysts Applied in the Hydrogen Evolution Reaction
Piontek, S. and Andronescu, C. and Zaichenko, A. and Konkena, B. and Junge Puring, K. and Marler, B. and Antoni, H. and Sinev, I. and Muhler, M. and Mollenhauer, D. and Roldan Cuenya, B. and Schuhmann, W. and Apfel, U.-P.
ACS CATALYSIS. Volume: 8 (2018) - 2018 • 295
Spectroscopical investigations on the redox chemistry of [FeFe]-hydrogenases in the presence of carbon monoxide
Laun, K. and Mebs, S. and Duan, J. and Wittkamp, F. and Apfel, U.-P. and Happe, T. and Winkler, M. and Haumann, M. and Stripp, S.T.
MOLECULES. Volume: 23 (2018) - 2017 • 294
Promoting Photocatalytic Overall Water Splitting by Controlled Magnesium Incorporation in SrTiO3 Photocatalysts
Han, K. and Lin, Y.-C. and Yang, C.-M. and Jong, R. and Mul, G. and Mei, B.
CHEMSUSCHEM. Volume: 10 (2017) - 2017 • 293
Chalcogenide substitution in the [2Fe] cluster of [FeFe]-hydrogenases conserves high enzymatic activity
Kertess, L. and Wittkamp, F. and Sommer, C. and Esselborn, J. and Rüdiger, O. and Reijerse, E.J. and Hofmann, E. and Lubitz, W. and Winkler, M. and Happe, T. and Apfel, U.-P.
DALTON TRANSACTIONS. Volume: 46 (2017) - 2017 • 292
Operando Phonon Studies of the Protonation Mechanism in Highly Active Hydrogen Evolution Reaction Pentlandite Catalysts
Zegkinoglou, I. and Zendegani, A. and Sinev, I. and Kunze, S. and Mistry, H. and Jeon, H.S. and Zhao, J. and Hu, M.Y. and Alp, E.E. and Piontek, S. and Smialkowski, M. and Apfel, U.-P. and Körmann, F. and Neugebauer, J. and Hickel, T. and Roldan Cuenya, B.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 139 (2017) - 2017 • 291
A kinetic Monte Carlo approach to diffusion-controlled thermal desorption spectroscopy
Schablitzki, T. and Rogal, J. and Drautz, R.
PHILOSOPHICAL TRANSACTIONS OF THE ROYAL SOCIETY A: MATHEMATICAL, PHYSICAL AND ENGINEERING SCIENCES. Volume: 375 (2017) - 2017 • 290
On the bifunctional nature of Cu/ZrO2 catalysts applied in the hydrogenation of ethyl acetate
Schittkowski, J. and Tölle, K. and Anke, S. and Stürmer, S. and Muhler, M.
JOURNAL OF CATALYSIS. Volume: 352 (2017) - 2017 • 289
Accumulating the hydride state in the catalytic cycle of [FeFe]-hydrogenases
Winkler, M. and Senger, M. and Duan, J. and Esselborn, J. and Wittkamp, F. and Hofmann, E. and Apfel, U.-P. and Stripp, S.T. and Happe, T.
NATURE COMMUNICATIONS. Volume: 8 (2017) - 2017 • 288
A combined low-pressure hydrogen peroxide evaporation plus hydrogen plasma treatment method for sterilization – Part 1: Characterization of the condensation process and proof-of-concept
Stapelmann, K. and Fiebrandt, M. and Raguse, M. and Lackmann, J.-W. and Postema, M. and Moeller, R. and Awakowicz, P.
PLASMA PROCESSES AND POLYMERS. Volume: 14 (2017) - 2017 • 287
Gold-Palladium Bimetallic Catalyst Stability: Consequences for Hydrogen Peroxide Selectivity
Pizzutilo, E. and Freakley, S.J. and Cherevko, S. and Venkatesan, S. and Hutchings, G.J. and Liebscher, C.H. and Dehm, G. and Mayrhofer, K.J.J.
ACS CATALYSIS. Volume: 7 (2017) - 2017 • 286
Recent progress in microstructural hydrogen mapping in steels: quantification, kinetic analysis, and multi-scale characterisation
Koyama, M. and Rohwerder, M. and Tasan, C.C. and Bashir, A. and Akiyama, E. and Takai, K. and Raabe, D. and Tsuzaki, K.
MATERIALS SCIENCE AND TECHNOLOGY (UNITED KINGDOM). Volume: (2017) - 2017 • 285
Electronic and molecular structure relations in diiron compounds mimicking the [FeFe]-hydrogenase active site studied by X-ray spectroscopy and quantum chemistry
Kositzki, R. and Mebs, S. and Schüth, N. and Leidel, N. and Schwartz, L. and Karnahl, M. and Wittkamp, F. and Daunke, D. and Grohmann, A. and Apfel, U.-P. and Gloaguen, F. and Ott, S. and Haumann, M.
DALTON TRANSACTIONS. Volume: 46 (2017) - 2017 • 284
Comparison of Langmuir probe and multipole resonance probe measurements in argon, hydrogen, nitrogen, and oxygen mixtures in a double ICP discharge
Fiebrandt, M. and Oberberg, M. and Awakowicz, P.
JOURNAL OF APPLIED PHYSICS. Volume: 122 (2017) - 2017 • 283
A Self-Powered Ethanol Biosensor
Ruff, A. and Pinyou, P. and Nolten, M. and Conzuelo, F. and Schuhmann, W.
CHEMELECTROCHEM. Volume: 4 (2017) - 2017 • 282
Interplay between CN- Ligands and the Secondary Coordination Sphere of the H-Cluster in [FeFe]-Hydrogenases
Lampret, O. and Adamska-Venkatesh, A. and Konegger, H. and Wittkamp, F. and Apfel, U.-P. and Reijerse, E.J. and Lubitz, W. and Rüdiger, O. and Happe, T. and Winkler, M.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 139 (2017) - 2017 • 281
Adsorption and desorption of hydrogen at nonpolar GaN(1 1 00) surfaces: Kinetics and impact on surface vibrational and electronic properties
Lymperakis, L. and Neugebauer, J. and Himmerlich, M. and Krischok, S. and Rink, M. and Kröger, J. and Polyakov, V.M.
PHYSICAL REVIEW B. Volume: 95 (2017) - 2017 • 280
Wireless light-emitting electrochemical rotors
Eßmann, V. and Voci, S. and Loget, G. and Sojic, N. and Schuhmann, W. and Kuhn, A.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS. Volume: 8 (2017) - 2017 • 279
The Influence of Water on the Performance of Molybdenum Carbide Catalysts in Hydrodeoxygenation Reactions: A Combined Theoretical and Experimental Study
Engelhardt, J. and Lyu, P. and Nachtigall, P. and Schüth, F. and García, Á.M.
CHEMCATCHEM. Volume: 9 (2017) - 2017 • 278
Sunlight-Dependent Hydrogen Production by Photosensitizer/Hydrogenase Systems
Adam, D. and Bösche, L. and Castañeda-Losada, L. and Winkler, M. and Apfel, U.-P. and Happe, T.
CHEMSUSCHEM. Volume: 10 (2017) - 2017 • 277
Hydrogen-assisted failure in Ni-based superalloy 718 studied under in situ hydrogen charging: The role of localized deformation in crack propagation
Tarzimoghadam, Z. and Ponge, D. and Klöwer, J. and Raabe, D.
ACTA MATERIALIA. Volume: 128 (2017) - 2017 • 276
Effects of Potassium and Manganese Promoters on Nitrogen-Doped Carbon Nanotube-Supported Iron Catalysts for CO2 Hydrogenation
Kangvansura, P. and Chew, L.M. and Kongmark, C. and Santawaja, P. and Ruland, H. and Xia, W. and Schulz, H. and Worayingyong, A. and Muhler, M.
ENGINEERING. Volume: 3 (2017) - 2017 • 275
Ultrathin High Surface Area Nickel Boride (NixB) Nanosheets as Highly Efficient Electrocatalyst for Oxygen Evolution
Masa, J. and Sinev, I. and Mistry, H. and Ventosa, E. and de la Mata, M. and Arbiol, J. and Muhler, M. and Roldan Cuenya, B. and Schuhmann, W.
ADVANCED ENERGY MATERIALS. Volume: (2017) - 2017 • 274
Interfacial hydrogen localization in austenite/martensite dual-phase steel visualized through optimized silver decoration and scanning Kelvin probe force microscopy
Nagashima, T. and Koyama, M. and Bashir, A. and Rohwerder, M. and Tasan, C.C. and Akiyama, E. and Raabe, D. and Tsuzaki, K.
MATERIALS AND CORROSION. Volume: 68 (2017) - 2017 • 273
Hydrogen enhances strength and ductility of an equiatomic high-entropy alloy
Luo, H. and Li, Z. and Raabe, D.
SCIENTIFIC REPORTS. Volume: 7 (2017) - 2017 • 272
Encapsulation of Bimetallic Metal Nanoparticles into Robust Zirconium-Based Metal-Organic Frameworks: Evaluation of the Catalytic Potential for Size-Selective Hydrogenation
Rösler, C. and Dissegna, S. and Rechac, V.L. and Kauer, M. and Guo, P. and Turner, S. and Ollegott, K. and Kobayashi, H. and Yamamoto, T. and Peeters, D. and Wang, Y. and Matsumura, S. and Van Tendeloo, G. and Kitagawa, H. and Muhler, M. and Llabrés i Xamena, F.X. and Fischer, R.A.
CHEMISTRY - A EUROPEAN JOURNAL. Volume: 23 (2017) - 2017 • 271
Overview of hydrogen embrittlement in high-Mn steels
Koyama, M. and Akiyama, E. and Lee, Y.-K. and Raabe, D. and Tsuzaki, K.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY. Volume: (2017) - 2017 • 270
Hydrogen effects on microstructural evolution and passive film characteristics of a duplex stainless steel
Luo, H. and Li, Z. and Chen, Y.-H. and Ponge, D. and Rohwerder, M. and Raabe, D.
ELECTROCHEMISTRY COMMUNICATIONS. Volume: 79 (2017) - 2017 • 269
Experimental and Theoretical Understanding of Nitrogen-Doping-Induced Strong Metal-Support Interactions in Pd/TiO2 Catalysts for Nitrobenzene Hydrogenation
Chen, P. and Khetan, A. and Yang, F. and Migunov, V. and Weide, P. and Stürmer, S.P. and Guo, P. and Kähler, K. and Xia, W. and Mayer, J. and Pitsch, H. and Simon, U. and Muhler, M.
ACS CATALYSIS. Volume: 7 (2017) - 2017 • 268
Hydrogen behaviour at twist {110} grain boundaries in α-Fe
McEniry, E.J. and Hickel, T. and Neugebauer, J.
PHILOSOPHICAL TRANSACTIONS OF THE ROYAL SOCIETY A: MATHEMATICAL, PHYSICAL AND ENGINEERING SCIENCES. Volume: 375 (2017) - 2017 • 267
The role of κ-carbides as hydrogen traps in high-Mn steels
Timmerscheidt, T.A. and Dey, P. and Bogdanovski, D. and von Appen, J. and Hickel, T. and Neugebauer, J. and Dronskowski, R.
METALS. Volume: 7 (2017) - 2017 • 266
Topotactic Synthesis of Porous Cobalt Ferrite Platelets from a Layered Double Hydroxide Precursor and Their Application in Oxidation Catalysis
Ortega, K.F. and Anke, S. and Salamon, S. and Özcan, F. and Heese, J. and Andronescu, C. and Landers, J. and Wende, H. and Schuhmann, W. and Muhler, M. and Lunkenbein, T. and Behrens, M.
CHEMISTRY - A EUROPEAN JOURNAL. Volume: (2017) - 2017 • 265
Beyond Water Splitting: Efficiencies of Photo-Electrochemical Devices Producing Hydrogen and Valuable Oxidation Products
Mei, B. and Mul, G. and Seger, B.
ADVANCED SUSTAINABLE SYSTEMS. Volume: 1 (2017) - 2017 • 264
A Polymer Multilayer Based Amperometric Biosensor for the Detection of Lactose in the Presence of High Concentrations of Glucose
Lopez, F. and Ma, S. and Ludwig, R. and Schuhmann, W. and Ruff, A.
ELECTROANALYSIS. Volume: 29 (2017) - 2017 • 263
Proton-Transfer Mechanisms at the Water-ZnO Interface: The Role of Presolvation
Quaranta, V. and Hellström, M. and Behler, J.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS. Volume: 8 (2017) - 2017 • 262
Proton-Coupled Reduction of the Catalytic [4Fe-4S] Cluster in [FeFe]-Hydrogenases
Senger, M. and Laun, K. and Wittkamp, F. and Duan, J. and Haumann, M. and Happe, T. and Winkler, M. and Apfel, U.-P. and Stripp, S.T.
ANGEWANDTE CHEMIE - INTERNATIONAL EDITION. Volume: 56 (2017) - 2017 • 261
Nanoporous Nitrogen-Doped Graphene Oxide/Nickel Sulfide Composite Sheets Derived from a Metal-Organic Framework as an Efficient Electrocatalyst for Hydrogen and Oxygen Evolution
Jayaramulu, K. and Masa, J. and Tomanec, O. and Peeters, D. and Ranc, V. and Schneemann, A. and Zboril, R. and Schuhmann, W. and Fischer, R.A.
ADVANCED FUNCTIONAL MATERIALS. Volume: (2017) - 2017 • 260
Nanophase Segregation of Self-Assembled Monolayers on Gold Nanoparticles
Meena, S.K. and Goldmann, C. and Nassoko, D. and Seydou, M. and Marchandier, T. and Moldovan, S. and Ersen, O. and Ribot, F. and Chanéac, C. and Sanchez, C. and Portehault, D. and Tielens, F. and Sulpizi, M.
ACS NANO. Volume: 11 (2017) - 2017 • 259
Protection and Reactivation of the [NiFeSe] Hydrogenase from Desulfovibrio vulgaris Hildenborough under Oxidative Conditions
Ruff, A. and Szczesny, J. and Zacarias, S. and Pereira, I.A.C. and Plumeré, N. and Schuhmann, W.
ACS ENERGY LETTERS. Volume: 2 (2017) - 2017 • 258
Transparent, mediator- and membrane-free enzymatic fuel cell based on nanostructured chemically modified indium tin oxide electrodes
González-Arribas, E. and Bobrowski, T. and Di Bari, C. and Sliozberg, K. and Ludwig, R. and Toscano, M.D. and De Lacey, A.L. and Pita, M. and Schuhmann, W. and Shleev, S.
BIOSENSORS AND BIOELECTRONICS. Volume: 97 (2017) - 2017 • 257
Metal–Organic Framework Derived Carbon Nanotube Grafted Cobalt/Carbon Polyhedra Grown on Nickel Foam: An Efficient 3D Electrode for Full Water Splitting
Aijaz, A. and Masa, J. and Rösler, C. and Xia, W. and Weide, P. and Fischer, R.A. and Schuhmann, W. and Muhler, M.
CHEMELECTROCHEM. Volume: 4 (2017) - 2017 • 256
A novel versatile microbiosensor for local hydrogen detection by means of scanning photoelectrochemical microscopy
Zhao, F. and Conzuelo, F. and Hartmann, V. and Li, H. and Stapf, S. and Nowaczyk, M.M. and Rögner, M. and Plumeré, N. and Lubitz, W. and Schuhmann, W.
BIOSENSORS AND BIOELECTRONICS. Volume: 94 (2017) - 2017 • 255
Bridging Hydride at Reduced H-Cluster Species in [FeFe]-Hydrogenases Revealed by Infrared Spectroscopy, Isotope Editing, and Quantum Chemistry
Mebs, S. and Senger, M. and Duan, J. and Wittkamp, F. and Apfel, U.-P. and Happe, T. and Winkler, M. and Stripp, S.T. and Haumann, M.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 139 (2017) - 2016 • 254
Structure and properties of ITQ-8: A hydrous layer silicate with microporous silicate layers
Marler, B. and Müller, M. and Gies, H.
DALTON TRANSACTIONS. Volume: 45 (2016) - 2016 • 253
The effect of sodium on the structure-activity relationships of cobalt-modified Cu/ZnO/Al2O3 catalysts applied in the hydrogenation of carbon monoxide to higher alcohols
Anton, J. and Nebel, J. and Song, H. and Froese, C. and Weide, P. and Ruland, H. and Muhler, M. and Kaluza, S.
JOURNAL OF CATALYSIS. Volume: 335 (2016) - 2016 • 252
A structural view of synthetic cofactor integration into [FeFe]-hydrogenases
Esselborn, J. and Muraki, N. and Klein, K. and Engelbrecht, V. and Metzler-Nolte, N. and Apfel, U.-P. and Hofmann, E. and Kurisu, G. and Happe, T.
CHEMICAL SCIENCE. Volume: 7 (2016) - 2016 • 251
A combined low-pressure hydrogen peroxide evaporation plus hydrogen plasma treatment method for sterilization - Part 2: An intercomparison study of different biological systems
Lackmann, J.-W. and Fiebrandt, M. and Raguse, M. and Kartaschew, K. and Havenith, M. and Bandow, J.E. and Moeller, R. and Awakowicz, P. and Stapelmann, K.
PLASMA PROCESSES AND POLYMERS. Volume: 14 (2016) - 2016 • 250
Intracellular Hydrogen Peroxide Detection with Functionalised Nanoelectrodes
Marquitan, M. and Clausmeyer, J. and Actis, P. and Córdoba, A.L. and Korchev, Y. and Mark, M.D. and Herlitze, S. and Schuhmann, W.
CHEMELECTROCHEM. Volume: 3 (2016) - 2016 • 249
New materials for the light-induced hydrogen evolution reaction from the Cu-Si-Ti-O system
Stein, H.S. and Gutkowski, R. and Siegel, A. and Schuhmann, W. and Ludwig, Al.
JOURNAL OF MATERIALS CHEMISTRY A. Volume: 4 (2016) - 2016 • 248
Product distribution of CO2 hydrogenation by K- and Mn-promoted Fe catalysts supported on N-functionalized carbon nanotubes
Kangvansura, P. and Chew, L.M. and Saengsui, W. and Santawaja, P. and Poo-arporn, Y. and Muhler, M. and Schulz, H. and Worayingyong, A.
CATALYSIS TODAY. Volume: 275 (2016) - 2016 • 247
Interplay of the Open Circuit Potential-Relaxation and the Dissolution Behavior of a Single H2 Bubble Generated at a Pt Microelectrode
Karnbach, F. and Yang, X. and Mutschke, G. and Fröhlich, J. and Eckert, J. and Gebert, A. and Tschulik, K. and Eckert, K. and Uhlemann, M.
JOURNAL OF PHYSICAL CHEMISTRY C. Volume: 120 (2016) - 2016 • 246
Bipolar Electrochemistry for Concurrently Evaluating the Stability of Anode and Cathode Electrocatalysts and the Overall Cell Performance during Long-Term Water Electrolysis
Eßmann, V. and Barwe, S. and Masa, J. and Schuhmann, W.
ANALYTICAL CHEMISTRY. Volume: 88 (2016) - 2016 • 245
Multiscale modeling of hydrogen enhanced homogeneous dislocation nucleation
Leyson, G.P.M. and Grabowski, B. and Neugebauer, J.
ACTA MATERIALIA. Volume: 107 (2016) - 2016 • 244
Wiring of the aldehyde oxidoreductase PaoABC to electrode surfaces via entrapment in low potential phenothiazine-modified redox polymers
Pinyou, P. and Ruff, A. and Pöller, S. and Alsaoub, S. and Leimkühler, S. and Wollenberger, U. and Schuhmann, W.
BIOELECTROCHEMISTRY. Volume: 109 (2016) - 2016 • 243
Molecular Dynamics Simulations of SFG Librational Modes Spectra of Water at the Water-Air Interface
Khatib, R. and Hasegawa, T. and Sulpizi, M. and Backus, E.H.G. and Bonn, M. and Nagata, Y.
JOURNAL OF PHYSICAL CHEMISTRY C. Volume: 120 (2016) - 2016 • 242
Understanding memory effects in Li-ion batteries: Evidence of a kinetic origin in TiO2 upon hydrogen annealing
Ventosa, E. and Löffler, T. and La Mantia, F. and Schuhmann, W.
CHEMICAL COMMUNICATIONS. Volume: 52 (2016) - 2016 • 241
A new force field including charge directionality for TMAO in aqueous solution
Usui, K. and Nagata, Y. and Hunger, J. and Bonn, M. and Sulpizi, M.
JOURNAL OF CHEMICAL PHYSICS. Volume: 145 (2016) - 2016 • 240
Oxygen and hydrogen evolution reactions on Ru, RuO2, Ir, and IrO2 thin film electrodes in acidic and alkaline electrolytes: A comparative study on activity and stability
Cherevko, S. and Geiger, S. and Kasian, O. and Kulyk, N. and Grote, J.-P. and Savan, A. and Shrestha, B.R. and Merzlikin, S. and Breitbach, B. and Ludwig, Al. and Mayrhofer, K.J.J.
CATALYSIS TODAY. Volume: 262 (2016) - 2016 • 239
Evaluation of kinetic constants on porous, non-noble catalyst layers for oxygen reduction - A comparative study between SECM and hydrodynamic methods
Dobrzeniecka, A. and Zeradjanin, A.R. and Masa, J. and Blicharska, M. and Wintrich, D. and Kulesza, P.J. and Schuhmann, W.
CATALYSIS TODAY. Volume: 262 (2016) - 2016 • 238
Multi-scale and spatially resolved hydrogen mapping in a Ni-Nb model alloy reveals the role of the δ phase in hydrogen embrittlement of alloy 718
Tarzimoghadam, Z. and Rohwerder, M. and Merzlikin, S.V. and Bashir, A. and Yedra, L. and Eswara, S. and Ponge, D. and Raabe, D.
ACTA MATERIALIA. Volume: 109 (2016) - 2016 • 237
The Temperature-Programmed Desorption of H2 from Cu/ZrO2
Schittkowski, J. and Buesen, D. and Toelle, K. and Muhler, M.
CATALYSIS LETTERS. Volume: 146 (2016) - 2016 • 236
Hydrogen-assisted damage in austenite/martensite dual-phase steel
Koyama, M. and Tasan, C.C. and Nagashima, T. and Akiyama, E. and Raabe, D. and Tsuzaki, K.
PHILOSOPHICAL MAGAZINE LETTERS. Volume: 96 (2016) - 2016 • 235
Concentration-Dependent Proton Transfer Mechanisms in Aqueous NaOH Solutions: From Acceptor-Driven to Donor-Driven and Back
Hellström, M. and Behler, J.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS. Volume: 7 (2016) - 2016 • 234
Making the hydrogen evolution reaction in polymer electrolyte membrane electrolysers even faster
Tymoczko, J. and Calle-Vallejo, F. and Schuhmann, W. and Bandarenka, A.S.
NATURE COMMUNICATIONS. Volume: 7 (2016) - 2016 • 233
A Nernstian Biosupercapacitor
Pankratov, D. and Conzuelo, F. and Pinyou, P. and Alsaoub, S. and Schuhmann, W. and Shleev, S.
ANGEWANDTE CHEMIE - INTERNATIONAL EDITION. Volume: 55 (2016) - 2016 • 232
Amorphous Cobalt Boride (Co2B) as a Highly Efficient Nonprecious Catalyst for Electrochemical Water Splitting: Oxygen and Hydrogen Evolution
Masa, J. and Weide, P. and Peeters, D. and Sinev, I. and Xia, W. and Sun, Z. Y. and Somsen, C. and Muhler, M. and Schuhmann, W.
ADVANCED ENERGY MATERIALS. Volume: 6 (2016) - 2016 • 231
First-principles investigation of hydrogen interaction with TiC precipitates in α -Fe
Di Stefano, D. and Nazarov, R. and Hickel, T. and Neugebauer, J. and Mrovec, M. and Elsässer, C.
PHYSICAL REVIEW B - CONDENSED MATTER AND MATERIALS PHYSICS. Volume: 93 (2016) - 2016 • 230
Single Nanoparticle Voltammetry: Contact Modulation of the Mediated Current
Li, X. and Batchelor-Mcauley, C. and Whitby, S.A.I. and Tschulik, K. and Shao, L. and Compton, R.G.
ANGEWANDTE CHEMIE - INTERNATIONAL EDITION. Volume: 55 (2016) - 2016 • 229
Hydrogen diffusion and trapping in Ti-modified advanced high strength steels
Winzer, N. and Rott, O. and Thiessen, R. and Thomas, I. and Mraczek, K. and Höche, T. and Wright, L. and Mrovec, M.
MATERIALS AND DESIGN. Volume: 92 (2016) - 2016 • 228
First-principles calculation of the elastic dipole tensor of a point defect: Application to hydrogen in α -zirconium
Nazarov, R. and Majevadia, J.S. and Patel, M. and Wenman, M.R. and Balint, D.S. and Neugebauer, J. and Sutton, A.P.
PHYSICAL REVIEW B - CONDENSED MATTER AND MATERIALS PHYSICS. Volume: 94 (2016) - 2016 • 227
Electrochemical Investigations of the Mechanism of Assembly of the Active-Site H-Cluster of [FeFe]-Hydrogenases
Megarity, C.F. and Esselborn, J. and Hexter, S.V. and Wittkamp, F. and Apfel, U.-P. and Happe, T. and Armstrong, F.A.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 138 (2016) - 2016 • 226
First principles characterisation of brittle transgranular fracture of titanium hydrides
Olsson, P.A.T. and Mrovec, M. and Kroon, M.
ACTA MATERIALIA. Volume: 118 (2016) - 2016 • 225
Simultaneous measurements of photocurrents and H2O2 evolution from solvent exposed photosystem 2 complexes
Vöpel, T. and Saw, E.N. and Hartmann, V. and Williams, R. and Müller, F. and Schuhmann, W. and Plumeré, N. and Nowaczyk, M. and Ebbinghaus, S. and Rögner, M.
BIOINTERPHASES. Volume: 11 (2016) - 2016 • 224
Pentlandite rocks as sustainable and stable efficient electrocatalysts for hydrogen generation
Konkena, B. and Puring, K.J. and Sinev, I. and Piontek, S. and Khavryuchenko, O. and Dürholt, J.P. and Schmid, R. and Tüysüz, H. and Muhler, M. and Schuhmann, W. and Apfel, U.-P.
NATURE COMMUNICATIONS. Volume: 7 (2016) - 2016 • 223
Co3O4 Nanoparticles Supported on Mesoporous Carbon for Selective Transfer Hydrogenation of α,β-Unsaturated Aldehydes
Wang, G.-H. and Deng, X. and Gu, D. and Chen, K. and Tüysüz, H. and Spliethoff, B. and Bongard, H.-J. and Weidenthaler, C. and Schmidt, W. and Schüth, F.
ANGEWANDTE CHEMIE - INTERNATIONAL EDITION. Volume: 55 (2016) - 2016 • 222
CO Hydrogenation to Higher Alcohols over Cu–Co-Based Catalysts Derived from Hydrotalcite-Type Precursors
Anton, J. and Nebel, J. and Göbel, C. and Gabrysch, T. and Song, H. and Froese, C. and Ruland, H. and Muhler, M. and Kaluza, S.
TOPICS IN CATALYSIS. Volume: 59 (2016) - 2016 • 221
[FeFe]-Hydrogenase with Chalcogenide Substitutions at the H-Cluster Maintains Full H2Evolution Activity
Noth, J. and Esselborn, J. and Güldenhaupt, J. and Brünje, A. and Sawyer, A. and Apfel, U.-P. and Gerwert, K. and Hofmann, E. and Winkler, M. and Happe, T.
ANGEWANDTE CHEMIE - INTERNATIONAL EDITION. Volume: 55 (2016) - 2016 • 220
Scanning electrochemical microscopy: Visualization of local electrocatalytic activity of transition metals hexacyanoferrates
Komkova, M.A. and Maljusch, A. and Sliozberg, K. and Schuhmann, W. and Karyakin, A.A.
RUSSIAN JOURNAL OF ELECTROCHEMISTRY. Volume: 52 (2016) - 2016 • 219
MoxC/CNT Composites as Active Electrocatalysts for the Hydrogen Evolution Reaction under Alkaline Conditions
Yang, F. and Sliozberg, K. and Antoni, H. and Xia, W. and Muhler, M.
ELECTROANALYSIS. Volume: 28 (2016) - 2016 • 218
Water orientation and hydrogen-bond structure at the fluorite/water interface
Khatib, R. and Backus, E.H.G. and Bonn, M. and Perez-Haro, M.-J. and Gaigeot, M.-P. and Sulpizi, M.
SCIENTIFIC REPORTS. Volume: 6 (2016) - 2016 • 217
How van der waals interactions determine the unique properties of water
Morawietz, T. and Singraber, A. and Dellago, C. and Behler, J.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA. Volume: 113 (2016) - 2016 • 216
Composites of fluoroapatite and methylmethacrylate-based polymers (PMMA) for biomimetic tooth replacement
Lübke, A. and Enax, J. and Wey, K. and Fabritius, H.-O. and Raabe, D. and Epple, M.
BIOINSPIRATION AND BIOMIMETICS. Volume: 11 (2016) - 2016 • 215
MoSSe@reduced graphene oxide nanocomposite heterostructures as efficient and stable electrocatalysts for the hydrogen evolution reaction
Konkena, B. and Masa, J. and Xia, W. and Muhler, M. and Schuhmann, W.
NANO ENERGY. Volume: 29 (2016) - 2016 • 214
Stepwise isotope editing of [FeFe]-hydrogenases exposes cofactor dynamics
Senger, M. and Mebs, S. and Duan, J. and Wittkamp, F. and Apfel, U.-P. and Heberle, J. and Haumann, M. and Stripp, S.T.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA. Volume: 113 (2016) - 2016 • 213
In Situ Hydrocracking of Fischer-Tropsch Hydrocarbons: CO-Prompted Diverging Reaction Pathways for Paraffin and α-Olefin Primary Products
Duyckaerts, N. and Trotuş, I.-T. and Swertz, A.-C. and Schüth, F. and Prieto, G.
ACS CATALYSIS. Volume: 6 (2016) - 2016 • 212
Design of an Os Complex-Modified Hydrogel with Optimized Redox Potential for Biosensors and Biofuel Cells
Pinyou, P. and Ruff, A. and Pöller, S. and Ma, S. and Ludwig, R. and Schuhmann, W.
CHEMISTRY - A EUROPEAN JOURNAL. Volume: 22 (2016) - 2015 • 211
Influence of the alkali metal cations on the activity of Pt(1 1 1) towards model electrocatalytic reactions in acidic sulfuric media
Tymoczko, J. and Colic, V. and Ganassin, A. and Schuhmann, W. and Bandarenka, A.S.
CATALYSIS TODAY. Volume: 244 (2015) - 2015 • 210
Enhancing Hydrogen Embrittlement Resistance of Lath Martensite by Introducing Nano-Films of Interlath Austenite
Wang, M. and Tasan, C.C. and Koyama, M. and Ponge, D. and Raabe, D.
METALLURGICAL AND MATERIALS TRANSACTIONS A: PHYSICAL METALLURGY AND MATERIALS SCIENCE. Volume: 46 (2015) - 2015 • 209
A sterically stabilized FeI-FeI semi-rotated conformation of [FeFe] hydrogenase subsite model
Goy, R. and Bertini, L. and Elleouet, C. and Görls, H. and Zampella, G. and Talarmin, J. and De Gioia, L. and Schollhammer, P. and Apfel, U.-P. and Weigand, W.
DALTON TRANSACTIONS. Volume: 44 (2015) - 2015 • 208
Semi-artificial photosynthetic z-scheme for hydrogen production from water
Kothe, T. and Schuhmann, W. and Rögner, M. and Plumeré, N.
BIOHYDROGEN. Volume: (2015) - 2015 • 207
Lipid Carbonyl Groups Terminate the Hydrogen Bond Network of Membrane-Bound Water
Ohto, T. and Backus, E.H.G. and Hsieh, C.-S. and Sulpizi, M. and Bonn, M. and Nagata, Y.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS. Volume: 6 (2015) - 2015 • 206
Influence of Adsorption Kinetics upon the Electrochemically Reversible Hydrogen Oxidation Reaction
Lin, C. and Jiao, X. and Tschulik, K. and Batchelor-Mcauley, C. and Compton, R.G.
JOURNAL OF PHYSICAL CHEMISTRY C. Volume: 119 (2015) - 2015 • 205
Representing the potential-energy surface of protonated water clusters by high-dimensional neural network potentials
Kondati Natarajan, S. and Morawietz, T. and Behler, J.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS. Volume: 17 (2015) - 2015 • 204
Light Induced H2 Evolution from a Biophotocathode Based on Photosystem 1 - Pt Nanoparticles Complexes Integrated in Solvated Redox Polymers Films
Zhao, F. and Conzuelo, F. and Hartmann, V. and Li, H. and Nowaczyk, M.M. and Plumeré, N. and Rögner, M. and Schuhmann, W.
JOURNAL OF PHYSICAL CHEMISTRY B. Volume: 119 (2015) - 2015 • 203
The Interaction of Formic Acid with Zinc Oxide: A Combined Experimental and Theoretical Study on Single Crystal and Powder Samples
Buchholz, M. and Li, Q. and Noei, H. and Nefedov, A. and Wang, Y. and Muhler, M. and Fink, K. and Wöll, C.
TOPICS IN CATALYSIS. Volume: 58 (2015) - 2015 • 202
Spatially and kinetically resolved mapping of hydrogen in a twinning-induced plasticity steel by use of Scanning Kelvin Probe Force Microscopy
Koyama, M. and Bashir, A. and Rohwerder, M. and Merzlikin, S.V. and Akiyama, E. and Tsuzaki, K. and Raabe, D.
JOURNAL OF THE ELECTROCHEMICAL SOCIETY. Volume: 162 (2015) - 2015 • 201
Energy storage technologies as options to a secure energy supply
Ausfelder, F. and Beilmann, C. and Bertau, M. and Bräuninger, S. and Heinzel, A. and Hoer, R. and Koch, W. and Mahlendorf, F. and Metzelthin, A. and Peuckert, M. and Plass, L. and Räuchle, K. and Reuter, M. and Schaub, G. and Schiebahn, S. and Schwab, E. and Schüth, F. and Stolten, D. and Teßmer, G. and Wagemann, K. and Ziegahn, K.-F.
CHEMIE-INGENIEUR-TECHNIK. Volume: 87 (2015) - 2015 • 200
Ab Initio Liquid Water Dynamics in Aqueous TMAO Solution
Usui, K. and Hunger, J. and Sulpizi, M. and Ohto, T. and Bonn, M. and Nagata, Y.
JOURNAL OF PHYSICAL CHEMISTRY B. Volume: 119 (2015) - 2015 • 199
Non-Thermal Dielectric Barrier Discharge (DBD) effects on proliferation and differentiation of human fibroblasts are primary mediated by hydrogen peroxide
Balzer, J. and Heuer, K. and Demir, E. and Hoffmanns, M.A. and Baldus, S. and Fuchs, P.C. and Awakowicz, P. and Suschek, C.V. and Opländer, C.
PLOS ONE. Volume: 10 (2015) - 2015 • 198
Mechanism of protection of catalysts supported in redox hydrogel films
Fourmond, V. and Stapf, S. and Li, H. and Buesen, D. and Birrell, J. and Rüdiger, O. and Lubitz, W. and Schuhmann, W. and Plumeré, N. and Léger, C.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 137 (2015) - 2015 • 197
A Redox Hydrogel Protects the O2-Sensitive [FeFe]-Hydrogenase from Chlamydomonas reinhardtii from Oxidative Damage
Oughli, A.A. and Conzuelo, F. and Winkler, M. and Happe, T. and Lubitz, W. and Schuhmann, W. and Rüdiger, O. and Plumeré, N.
ANGEWANDTE CHEMIE - INTERNATIONAL EDITION. Volume: 54 (2015) - 2015 • 196
The subtleties of the reversible hydrogen evolution reaction arising from the nonunity stoichiometry
Jiao, X. and Batchelor-Mcauley, C. and Kätelhön, E. and Ellison, J. and Tschulik, K. and Compton, R.G.
JOURNAL OF PHYSICAL CHEMISTRY C. Volume: 119 (2015) - 2015 • 195
Fast and Reproducible Testing of Cu-Co-Based Catalysts Applied in the Conversion of Synthesis Gas to Ethanol and Higher Alcohols
Anton, J. and Ruland, H. and Kaluza, S. and Muhler, M.
CATALYSIS LETTERS. Volume: 145 (2015) - 2015 • 194
First-principles investigation of quantum mechanical effects on the diffusion of hydrogen in iron and nickel
Di Stefano, D. and Mrovec, M. and Elsässer, C.
PHYSICAL REVIEW B - CONDENSED MATTER AND MATERIALS PHYSICS. Volume: 92 (2015) - 2015 • 193
First-principles investigation of hydrogen trapping and diffusion at grain boundaries in nickel
Di Stefano, D. and Mrovec, M. and Elsässer, C.
ACTA MATERIALIA. Volume: 98 (2015) - 2015 • 192
Hydrogen diffusion and segregation in α iron ∑ 3 (111) grain boundaries
Hamza, M. and Hatem, T.M. and Raabe, D. and El-Awady, J.A.
ASME INTERNATIONAL MECHANICAL ENGINEERING CONGRESS AND EXPOSITION, PROCEEDINGS (IMECE). Volume: 9-2015 (2015) - 2015 • 191
Controlling the charge of pH-responsive redox hydrogels by means of redox-silent biocatalytic processes. A biocatalytic off/on switch
Contin, A. and Plumeré, N. and Schuhmann, W.
ELECTROCHEMISTRY COMMUNICATIONS. Volume: 51 (2015) - 2015 • 190
Ultra-small Palladium Nanoparticle Decorated Carbon Nanotubes: Conductivity and Reactivity
Li, X. and Batchelor-McAuley, C. and Tschulik, K. and Shao, L. and Compton, R.G.
CHEMPHYSCHEM. Volume: 16 (2015) - 2015 • 189
Toward economical purification of styrene monomers: Eggshell Mo2C for front-end hydrogenation of phenylacetylene
Pang, M. and Shao, Z. F. and Wang, X. K. and Liang, C. H. and Xia, W.
AICHE JOURNAL. Volume: 61 (2015) - 2015 • 188
Cocatalyst Designing: A Regenerable Molybdenum-Containing Ternary Cocatalyst System for Efficient Photocatalytic Water Splitting
Busser, G.W. and Mei, B. and Weide, P. and Vesborg, P.C.K. and Stührenberg, K. and Bauer, M. and Huang, X. and Willinger, M.-G. and Chorkendorff, I. and Schlögl, R. and Muhler, M.
ACS CATALYSIS. Volume: 5 (2015) - 2015 • 187
Influence of water on supra-molecular assembly of 4, 4′-dihydroxy azobenzene on Ag(111)
Henzl, J. and Boom, K. and Morgenstern, K.
JOURNAL OF CHEMICAL PHYSICS. Volume: 142 (2015) - 2015 • 186
Atomic layer-by-layer construction of Pd on nanoporous gold via underpotential deposition and displacement reaction
Yan, X. and Xiong, H. and Bai, Q. and Frenzel, J. and Si, C. and Chen, X. and Eggeler, G. and Zhang, Z.
RSC ADVANCES. Volume: 5 (2015) - 2015 • 185
CNT-TiO2-δ composites for improved co-catalyst dispersion and stabilized photocatalytic hydrogen production
Chen, P. and Wang, L. and Wang, P. and Kostka, A. and Wark, M. and Muhler, M. and Beranek, R.
CATALYSTS. Volume: 5 (2015) - 2015 • 184
Butadiene from acetylene-ethylene cross-metathesis
Trotuş, I.-T. and Zimmermann, T. and Duyckaerts, N. and Geboers, J. and Schüth, F.
CHEMICAL COMMUNICATIONS. Volume: 51 (2015) - 2015 • 183
Preparation and sintering behaviour of La5.4WO12-δ asymmetric membranes with optimised microstructure for hydrogen separation
Deibert, W. and Ivanova, M. E. and Meulenberg, W. A. and Vassen, R. and Guillon, O.
JOURNAL OF MEMBRANE SCIENCE. Volume: 492 (2015) - 2015 • 182
Modelling and proper evaluation of volumetric kinetics of hydrogen desorption by metal hydrides
Drozdov, I.V. and Kochubey, V. and Meng, L. and Mauer, G. and Vaßen, R. and Stöver, D.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY. Volume: 40 (2015) - 2015 • 181
Modelling and evaluation of hydrogen desorption kinetics controlled by surface reaction and bulk diffusion for magnesium hydride
Drozdov, I.V. and Vaßen, R. and Stöver, D.
RSC ADVANCES. Volume: 5 (2015) - 2015 • 180
Film Stress of Amorphous Hydrogenated Carbon on Biaxially Oriented Polyethylene Terephthalate
Bahre, H. and Behm, H. and Grochla, D. and Böke, M., and Dahlmann, R., and Hopmann, C., and Ludwig, Al., and Winter, J.
PLASMA PROCESSES AND POLYMERS. Volume: 12 (2015) - 2015 • 179
Coupling of an enzymatic biofuel cell to an electrochemical cell for self-powered glucose sensing with optical readout
Pinyou, P. and Conzuelo, F. and Sliozberg, K. and Vivekananthan, J. and Contin, A. and Pöller, S. and Plumeré, N. and Schuhmann, W.
BIOELECTROCHEMISTRY. Volume: 106 (2015) - 2015 • 178
Propanoate grafting on (H,OH)-Si(0 0 1)-2×1
Bournel, F. and Gallet, J.-J. and Köhler, U. and Ellakhmissi, B.B. and Kubsky, S. and Carniato, S. and Rochet, F.
JOURNAL OF PHYSICS CONDENSED MATTER. Volume: 27 (2015) - 2014 • 177
Particle size effects in the catalytic electroreduction of CO2 on Cu nanoparticles
Reske, R. and Mistry, H. and Behafarid, F. and Roldan Cuenya, B. and Strasser, P.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 136 (2014) - 2014 • 176
Metal-free catalysts for oxygen reduction in alkaline electrolytes: Influence of the presence of Co, Fe, Mn and Ni inclusions
Masa, J. and Zhao, A. and Wei, X. and Muhler, M. and Schuhmann, W.
ELECTROCHIMICA ACTA. Volume: 128 (2014) - 2014 • 175
Large-scale synthesis and catalytic activity of nanoporous Cu-O system towards CO oxidation
Kou, T. and Si, C. and Gao, Y. and Frenzel, J. and Wang, H. and Yan, X. and Bai, Q. and Eggeler, G. and Zhang, Z.
RSC ADVANCES. Volume: 4 (2014) - 2014 • 174
Ferrocene in the metal-organic framework MOF-5 studied by homo- and heteronuclear correlation NMR and MD simulation
Wehring, M. and Magusin, P.C.M.M. and Amirjalayer, S. and Schmid, R. and Stallmach, F.
MICROPOROUS AND MESOPOROUS MATERIALS. Volume: 186 (2014) - 2014 • 173
Ceramic materials for H2 transport membranes applicable for gas separation under coal-gasification-related conditions
van Holt, D. and Forster, E. and Ivanova, M.E. and Meulenberg, W.A. and Müller, M. and Baumann, S. and Vaßen, R.
JOURNAL OF THE EUROPEAN CERAMIC SOCIETY. Volume: 34 (2014) - 2014 • 172
The effect of notches on the fatigue behavior in NiTi shape memory alloys
Wang, X.M. and Cao, W. and Deng, C.H. and Liu, H. and Pfetzing-Micklich, J. and Yue, Z.F.
MATERIALS SCIENCE AND ENGINEERING A. Volume: 610 (2014) - 2014 • 171
A stacked sensor concept for industry compatible plasma diagnostics
Schulz, C. and Will, B. and Rolfes, I.
PROCEEDINGS - 2014 INTERNATIONAL CONFERENCE ON ELECTROMAGNETICS IN ADVANCED APPLICATIONS, ICEAA 2014. Volume: (2014) - 2014 • 170
Cellobiose dehydrogenase entrapped within specifically designed Os-complex modified electrodeposition polymers as potential anodes for biofuel cells
Shao, M. and Guschin, D.A. and Kawah, Z. and Beyl, Y. and Stoica, L. and Ludwig, R. and Schuhmann, W. and Chen, X.
ELECTROCHIMICA ACTA. Volume: 128 (2014) - 2014 • 169
Exceptional size-dependent activity enhancement in the electroreduction of CO2 over Au nanoparticles
Mistry, H. and Reske, R. and Zeng, Z. and Zhao, Z.-J. and Greeley, J. and Strasser, P. and Cuenya, B.R.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 136 (2014) - 2014 • 168
Effect of nitrogen doping on the reducibility, activity and selectivity of carbon nanotube-supported iron catalysts applied in CO2 hydrogenation
Chew, L.M. and Kangvansura, P. and Ruland, H. and Schulte, H.J. and Somsen, C. and Xia, W. and Eggeler, G. and Worayingyong, A. and Muhler, M.
APPLIED CATALYSIS A: GENERAL. Volume: 482 (2014) - 2014 • 167
A H2 very high frequency capacitively coupled plasma inactivates glyceraldehyde 3-phosphate dehydrogenase(GapDH) more efficiently than UV photons and heat combined
Stapelmann, K. and Lackmann, J.-W. and Buerger, I. and Bandow, J.E. and Awakowicz, P.
JOURNAL OF PHYSICS D: APPLIED PHYSICS. Volume: 47 (2014) - 2014 • 166
PQQ-sGDH bioelectrodes based on os-complex modified electrodeposition polymers and carbon nanotubes
Chen, X. and Shao, M. and Pöller, S. and Guschin, D. and Pinyou, P. and Schuhmann, W.
JOURNAL OF THE ELECTROCHEMICAL SOCIETY. Volume: 161 (2014) - 2014 • 165
Targeted manipulation of metal-organic frameworks to direct sorption properties
Schneemann, A. and Henke, S. and Schwedler, I. and Fischer, R.A.
CHEMPHYSCHEM. Volume: 15 (2014) - 2014 • 164
Strong negative nanocatalysis: Oxygen reduction and hydrogen evolution at very small (2 nm) gold nanoparticles
Wang, Y. and Laborda, E. and Tschulik, K. and Damm, C. and Molina, A. and Compton, R.G.
NANOSCALE. Volume: 6 (2014) - 2014 • 163
Multiscale Approaches to Hydrogen-Assisted Degradation of Metals
Winzer, N. and Mrovec, M.
JOM. Volume: 66 (2014) - 2014 • 162
Reactivity of metal catalysts in glucose-fructose conversion
Loerbroks, C. and vanRijn, J. and Ruby, M.-P. and Tong, Q. and Schüth, F. and Thiel, W.
CHEMISTRY - A EUROPEAN JOURNAL. Volume: 20 (2014) - 2014 • 161
Hydrogen-assisted decohesion and localized plasticity in dual-phase steel
Koyama, M. and Tasan, C.C. and Akiyama, E. and Tsuzaki, K. and Raabe, D.
ACTA MATERIALIA. Volume: 70 (2014) - 2014 • 160
Biofuel-Cell Cathodes Based on Bilirubin Oxidase Immobilized through Organic Linkers on 3D Hierarchically Structured Carbon Electrodes
Vivekananthan, J. and Rincón, R.A. and Kuznetsov, V. and Pöller, S. and Schuhmann, W.
CHEMELECTROCHEM. Volume: 1 (2014) - 2014 • 159
Energy Carriers Made from Hydrogen
Djinović, P. and Schüth, F.
ELECTROCHEMICAL ENERGY STORAGE FOR RENEWABLE SOURCES AND GRID BALANCING. Volume: (2014) - 2014 • 158
Ab initio based understanding of the segregation and diffusion mechanisms of hydrogen in steels
Hickel, T. and Nazarov, R. and McEniry, E.J. and Leyson, G. and Grabowski, B. and Neugebauer, J.
JOM. Volume: 66 (2014) - 2014 • 157
The amorphous silica-liquid water interface studied by ab initio molecular dynamics (AIMD): Local organization in global disorder
Cimas, Á. and Tielens, F. and Sulpizi, M. and Gaigeot, M.-P. and Costa, D.
JOURNAL OF PHYSICS CONDENSED MATTER. Volume: 26 (2014) - 2014 • 156
D-lactate-selective amperometric biosensor based on the cell debris of the recombinant yeast Hansenula polymorpha
Smutok, O.V. and Dmytruk, K.V. and Karkovska, M.I. and Schuhmann, W. and Gonchar, M.V. and Sibirny, A.A.
TALANTA. Volume: 125 (2014) - 2014 • 155
A redox hydrogel protects hydrogenase from high-potential deactivation and oxygen damage
Plumeré, N. and Rüdiger, O. and Oughli, A.A. and Williams, R. and Vivekananthan, J. and Pöller, S. and Schuhmann, W. and Lubitz, W.
NATURE CHEMISTRY. Volume: 6 (2014) - 2014 • 154
Low temperature Hydrogen Reduction of High Surface Area Anatase and Anatase/β-TiO2 for High-Charging-Rate Batteries
Ventosa, E. and Tymoczko, A. and Xie, K. and Xia, W. and Muhler, M. and Schuhmann, W.
CHEMSUSCHEM. Volume: 7 (2014) - 2014 • 153
Hydrogen production from catalytic decomposition of methane over ordered mesoporous carbons (CMK-3) and carbide-derived carbon (DUT-19)
Shilapuram, V. and Ozalp, N. and Oschatz, M. and Borchardt, L. and Kaskel, S.
CARBON. Volume: 67 (2014) - 2014 • 152
Hydrogen evolution from metal-surface hydroxyl interaction
Fujimori, Y. and Kaden, W.E. and Brown, M.A. and Roldan Cuenya, B. and Sterrer, M. and Freund, H.-J.
JOURNAL OF PHYSICAL CHEMISTRY C. Volume: 118 (2014) - 2014 • 151
Encapsulation strategies in energy conversion materials
Schüth, F.
CHEMISTRY OF MATERIALS. Volume: 26 (2014) - 2014 • 150
Hydrogen embrittlement of a carbon segregated σ5 (310) [001] symmetrical tilt grain boundary in α-Fe
Tahir, A.M. and Janisch, R. and Hartmaier, A.
MATERIALS SCIENCE AND ENGINEERING A. Volume: 612 (2014) - 2014 • 149
Hydrogen embrittlement associated with strain localization in a precipitation-hardened Fe-Mn-Al-C light weight austenitic steel
Koyama, M. and Springer, H. and Merzlikin, S.V. and Tsuzaki, K. and Akiyama, E. and Raabe, D.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY. Volume: 39 (2014) - 2014 • 148
Thermogravimetric analysis of activated carbons, ordered mesoporous carbide-derived carbons, and their deactivation kinetics of catalytic methane decomposition
Shilapuram, V. and Ozalp, N. and Oschatz, M. and Borchardt, L. and Kaskel, S. and Lachance, R.
INDUSTRIAL AND ENGINEERING CHEMISTRY RESEARCH. Volume: 53 (2014) - 2014 • 147
Multimetallic aerogels by template-free self-assembly of Au, Ag, Pt, and Pd nanoparticles
Herrmann, A.-K. and Formanek, P. and Borchardt, L. and Klose, M. and Giebeler, L. and Eckert, J. and Kaskel, S. and Gaponik, N. and Eychmüller, A.
CHEMISTRY OF MATERIALS. Volume: 26 (2014) - 2014 • 146
Electrochemical nanoprobes for single-cell analysis
Actis, P. and Tokar, S. and Clausmeyer, J. and Babakinejad, B. and Mikhaleva, S. and Cornut, R. and Takahashi, Y. and López Córdoba, A. and Novak, P. and Shevchuck, A.I. and Dougan, J.A. and Kazarian, S.G. and Gorelkin, P.V. and Erofeev, A.S. and Yaminsky, I.V. and Unwin, P.R. and Schuhmann, W. and Klenerman, D. and Rusakov, D.A. and Sviderskaya, E.V. and Korchev, Y.E.
ACS NANO. Volume: 8 (2014) - 2014 • 145
Interface effects in NaAlH4-carbon nanocomposites for hydrogen storage
Gao, J. and Ngene, P. and Herrich, M. and Xia, W. and Gutfleisch, O. and Muhler, M. and De Jong, K.P. and De Jongh, P.E.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY. Volume: 39 (2014) - 2014 • 144
Nanosensors for the detection of hydrogen peroxide
Clausmeyer, J. and Actis, P. and López Córdoba, A. and Korchev, Y. and Schuhmann, W.
ELECTROCHEMISTRY COMMUNICATIONS. Volume: 40 (2014) - 2014 • 143
Impact of Mn on the solution enthalpy of hydrogen in austenitic Fe-Mn alloys: A first-principles study
Von Appen, J. and Dronskowski, R. and Chakrabarty, A. and Hickel, T. and Spatschek, R. and Neugebauer, J.
JOURNAL OF COMPUTATIONAL CHEMISTRY. Volume: 35 (2014) - 2014 • 142
A molecular iron catalyst for the acceptorless dehydrogenation and hydrogenation of N-heterocycles
Chakraborty, S. and Brennessel, W.W. and Jones, W.D.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 136 (2014) - 2014 • 141
Multifunctional, defect-engineered metal-organic frameworks with ruthenium centers: Sorption and catalytic properties
Kozachuk, O. and Luz, I. and Llabrés I Xamena, F.X. and Noei, H. and Kauer, M. and Albada, H.B. and Bloch, E.D. and Marler, B. and Wang, Y. and Muhler, M. and Fischer, R.A.
ANGEWANDTE CHEMIE - INTERNATIONAL EDITION. Volume: 53 (2014) - 2014 • 140
Pressure-dependent effect of hydrogen adsorption on structural and electronic properties of Pt/γ-Al2O3 nanoparticles
Mistry, H. and Behafarid, F. and Bare, S.R. and Roldan Cuenya, B.
CHEMCATCHEM. Volume: 6 (2014) - 2014 • 139
Alloy Design, Combinatorial Synthesis, and Microstructure–Property Relations for Low-Density Fe-Mn-Al-C Austenitic Steels
Raabe, D. and Springer, H. and Gutierrez-Urrutia, I. and Roters, F. and Bausch, M. and Seol, J.-B. and Koyama, M. and Choi, P.-P. and Tsuzaki, K.
JOM. Volume: 66 (2014) - 2014 • 138
Topotactic condensation of layer silicates with ferrierite-type layers forming porous tectosilicates
Marler, B. and Wang, Y. and Song, J. and Gies, H.
DALTON TRANSACTIONS. Volume: 43 (2014) - 2014 • 137
Using the first steps of hydration for the determination of molecular conformation of a single molecule
Henzl, J. and Boom, K. and Morgenstern, K.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 136 (2014) - 2014 • 136
CO 2 hydrogenation to hydrocarbons over iron nanoparticles supported on oxygen-functionalized carbon nanotubes
Chew, L.M. and Ruland, H. and Schulte, H.J. and Xia, W. and Muhler, M.
JOURNAL OF CHEMICAL SCIENCES. Volume: 126 (2014) - 2014 • 135
[FeFe]-hydrogenase models assembled into vesicular structures
Menzel, K. and Apfel, U.-P. and Wolter, N. and Rüger, R. and Alpermann, T. and Steiniger, F. and Gabel, D. and Förster, S. and Weigand, W. and Fahr, A.
JOURNAL OF LIPOSOME RESEARCH. Volume: 24 (2014) - 2014 • 134
Interaction of cobalt nanoparticles with oxygen- and nitrogen- functionalized carbon nanotubes and impact on nitrobenzene hydrogenation catalysis
Chen, P. and Yang, F. and Kostka, A. and Xia, W.
ACS CATALYSIS. Volume: 4 (2014) - 2014 • 133
Benzaldehyde on water-saturated Si(001): Reaction with isolated silicon dangling bonds versus concerted hydrosilylation
Pierucci, D. and Naitabdi, A. and Bournel, F. and Gallet, J.-J. and Tissot, H. and Carniato, S. and Rochet, F. and Köhler, U. and Laumann, D. and Kubsky, S. and Silly, M.G. and Sirotti, F.
JOURNAL OF PHYSICAL CHEMISTRY C. Volume: 118 (2014) - 2014 • 132
[FeFe] Hydrogenase Models: An Overview
Apfel, U. and Pétillon, F.Y. and Schollhammer, P. and Talarmin, J. and Weigand, W.
BIOINSPIRED CATALYSIS: METAL-SULFUR COMPLEXES. Volume: (2014) - 2014 • 131
Interaction of charged amino-acid side chains with ions: An optimization strategy for classical force fields
Kahlen, J. and Salimi, L. and Sulpizi, M. and Peter, C. and Donadio, D.
JOURNAL OF PHYSICAL CHEMISTRY B. Volume: 118 (2014) - 2014 • 130
Atom probe tomography observation of hydrogen in high-Mn steel and silver charged via an electrolytic route
Haley, D. and Merzlikin, S.V. and Choi, P. and Raabe, D.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY. Volume: 39 (2014) - 2014 • 129
Protection of p+-n-Si photoanodes by sputter-deposited Ir/IrOx thin films
Mei, B. and Seger, B. and Pedersen, T. and Malizia, M. and Hansen, O. and Chorkendorff, I. and Vesborg, P.C.K.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS. Volume: 5 (2014) - 2014 • 128
Iron-treated NiO as a highly transparent p-type protection layer for efficient Si-based photoanodes
Mei, B. and Permyakova, A.A. and Frydendal, R. and Bae, D. and Pedersen, T. and Malacrida, P. and Hansen, O. and Stephens, I.E.L. and Vesborg, P.C.K. and Seger, B. and Chorkendorff, I.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS. Volume: 5 (2014) - 2014 • 127
Immunologically Controlled Biofuel Cell as a Self-Powered Biosensor for Antibiotic Residue Determination
Conzuelo, F. and Vivekananthan, J. and Pöller, S. and Pingarrón, J.M. and Schuhmann, W.
CHEMELECTROCHEM. Volume: 1 (2014) - 2014 • 126
Iron-based catalysts for the hydrogenation of esters to alcohols
Chakraborty, S. and Dai, H. and Bhattacharya, P. and Fairweather, N.T. and Gibson, M.S. and Krause, J.A. and Guan, H.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 136 (2014) - 2014 • 125
Immobilization of proteins in their physiological active state at functionalized thiol monolayers on ATR-germanium crystals
Schartner, J. and Gavriljuk, K. and Nabers, A. and Weide, P. and Muhler, M. and Gerwert, K. and Kötting, C.
CHEMBIOCHEM. Volume: 15 (2014) - 2014 • 124
Combined In Situ XPS and UHV- Chemical Force Microscopy ( CFM) Studies of the Plasma Induced Surface Oxidation of Polypropylene
Ozkaya, B. and Grosse-Kreul, S. and Corbella, C. and von Keudell, A. and Grundmeier, G.
PLASMA PROCESSES AND POLYMERS. Volume: 11 (2014) - 2014 • 123
Platinum-cobalt bimetallic nanoparticles in hollow carbon nanospheres for hydrogenolysis of 5-hydroxymethylfurfural
Wang, G.-H. and Hilgert, J. and Richter, F.H. and Wang, F. and Bongard, H.-J. and Spliethoff, B. and Weidenthaler, C. and Schüth, F.
NATURE MATERIALS. Volume: 13 (2014) - 2013 • 122
S-N fatigue properties of a stable high-aluminum austenitic stainless steel for hydrogen applications
Michler, T. and Naumann, J. and Weber, S. and Martin, M. and Pargeter, R.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY. Volume: 38 (2013) - 2013 • 121
Femtosecond-laser processing of nitrobiphenylthiol self-assembled monolayers
Schröter, A. and Franzka, S. and Koch, J. and Chichkov, B.N. and Ostendorf, A. and Hartmann, N.
APPLIED SURFACE SCIENCE. Volume: 278 (2013) - 2013 • 120
Improving the current density and the coulombic efficiency by a cascade reaction of glucose oxidizing enzymes
Zafar, M.N. and Shao, M. and Ludwig, R. and Leech, D. and Schuhmann, W. and Gorton, L.
ECS TRANSACTIONS. Volume: 53 (2013) - 2013 • 119
A novel [FeFe] hydrogenase model with a (SCH2)2Pi=O moiety
Almazahreh, L.R. and Apfel, U.-P. and Imhof, W. and Rudolph, M. and Görls, H. and Talarmin, J. and Schollhammer, P. and El-Khateeb, M. and Weigand, W.
ORGANOMETALLICS. Volume: 32 (2013) - 2013 • 118
SIMS analysis on austenitic stainless steel: The influence of type of oxide surface layer on hydrogen embrittlement
Izawa, C. and Wagner, S. and Martin, M. and Weber, S. and Pargeter, R. and Michler, T. and Uchida, H.H. and Pundt, A.
JOURNAL OF ALLOYS AND COMPOUNDS. Volume: 580 (2013) - 2013 • 117
Insights into the topotactic conversion process from layered silicate RUB-36 to FER-type zeolite by layer reassembly
Zhao, Z. and Zhang, W. and Ren, P. and Han, X. and Müller, U. and Yilmaz, B. and Feyen, M. and Gies, H. and Xiao, F.-S. and De Vos, D. and Tatsumi, T. and Bao, X.
CHEMISTRY OF MATERIALS. Volume: 25 (2013) - 2013 • 116
Mutual enhancement of the current density and the coulombic efficiency for a bioanode by entrapping bi-enzymes with Os-complex modified electrodeposition paints
Shao, M. and Nadeem Zafar, M. and Sygmund, C. and Guschin, D.A. and Ludwig, R. and Peterbauer, C.K. and Schuhmann, W. and Gorton, L.
BIOSENSORS AND BIOELECTRONICS. Volume: 40 (2013) - 2013 • 115
A silicon-heteroaromatic system as photosensitizer for light-driven hydrogen production by hydrogenase mimics
Goy, R. and Apfel, U.-P. and Elleouet, C. and Escudero, D. and Elstner, M. and Görls, H. and Talarmin, J. and Schollhammer, P. and González, L. and Weigand, W.
EUROPEAN JOURNAL OF INORGANIC CHEMISTRY. Volume: (2013) - 2013 • 114
Optimization of a membraneless glucose/oxygen enzymatic fuel cell based on a bioanode with high coulombic efficiency and current density
Shao, M. and Zafar, M.N. and Falk, M. and Ludwig, R. and Sygmund, C. and Peterbauer, C.K. and Guschin, D.A. and MacAodha, D. and Conghaile, P.Ó. and Leech, D. and Toscano, M.D. and Shleev, S. and Schuhmann, W. and Gorton, L.
CHEMPHYSCHEM. Volume: 14 (2013) - 2013 • 113
Evidence for metal-support interactions in Au modified TiO x/SBA-15 materials prepared by photodeposition
Mei, B. and Wiktor, C. and Turner, S. and Pougin, A. and Van Tendeloo, G. and Fischer, R.A. and Muhler, M. and Strunk, J.
ACS CATALYSIS. Volume: 3 (2013) - 2013 • 112
Reorientation of a single bond within an adsorbed molecule by tunneling electrons
Henzl, J. and Boom, K. and Morgenstern, K.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 135 (2013) - 2013 • 111
Mechanocatalytic depolymerization of cellulose combined with hydrogenolysis as a highly efficient pathway to sugar alcohols
Hilgert, J. and Meine, N. and Rinaldi, R. and Schüth, F.
ENERGY AND ENVIRONMENTAL SCIENCE. Volume: 6 (2013) - 2013 • 110
A full-dimensional neural network potential-energy surface for water clusters up to the hexamer
Morawietz, T. and Behler, J.
ZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE. Volume: 227 (2013) - 2013 • 109
Dense membranes for oxygen and hydrogen separation (DEMOYS): Project overview and first results
Pinacci, P. and Louradour, E. and Wimbert, L. and Gindrat, M. and Jarligo, M.O. and Vassen, R. and Comite, A. and Serra, J.M. and Jewulski, J. and Mancuso, L. and Chiesa, P. and Prestat, M. and Ivers-Tiffée, E.
ENERGY PROCEDIA. Volume: 37 (2013) - 2013 • 108
The influence of the residual growth catalyst in functionalized carbon nanotubes on supported Pt nanoparticles applied in selective olefin hydrogenation
Chen, P. and Chew, L.M. and Xia, W.
JOURNAL OF CATALYSIS. Volume: 307 (2013) - 2013 • 107
Biomimetic assembly of the [FeFe] hydrogenase: Synthetic mimics in a biological shell
Apfel, U.-P. and Weigand, W.
CHEMBIOCHEM. Volume: 14 (2013) - 2013 • 106
Hydrogen-assisted failure in a twinning-induced plasticity steel studied under in situ hydrogen charging by electron channeling contrast imaging
Koyama, M. and Akiyama, E. and Tsuzaki, K. and Raabe, D.
ACTA MATERIALIA. Volume: 61 (2013) - 2013 • 105
Application of SECM in tracing of hydrogen peroxide at multicomponent non-noble electrocatalyst films for the oxygen reduction reaction
Dobrzeniecka, A. and Zeradjanin, A. and Masa, J. and Puschhof, A. and Stroka, J. and Kulesza, P.J. and Schuhmann, W.
CATALYSIS TODAY. Volume: 202 (2013) - 2013 • 104
Ab Initio Based conformational study of the crystalline α-chitin
Petrov, M. and Lymperakis, L. and Friák, M. and Neugebauer, J.
BIOPOLYMERS. Volume: 99 (2013) - 2013 • 103
The structural and electronic promoting effect of nitrogen-doped carbon nanotubes on supported Pd nanoparticles for selective olefin hydrogenation
Chen, P. and Chew, L.M. and Kostka, A. and Muhler, M. and Xia, W.
CATALYSIS SCIENCE AND TECHNOLOGY. Volume: 3 (2013) - 2013 • 102
Performance of silver nanoparticles in the catalysis of the oxygen reduction reaction in neutral media: Efficiency limitation due to hydrogen peroxide escape
Neumann, C.C.M. and Laborda, E. and Tschulik, K. and Ward, K.R. and Compton, R.G.
NANO RESEARCH. Volume: 6 (2013) - 2013 • 101
A Z′ = 6 crystal structure of (E)-N,N′-dicyclohexylacetamidine
Krasnopolski, M. and Seidel, R.W. and Goddard, R. and Breidung, J. and Winter, M.V. and Devi, A. and Fischer, R.A.
JOURNAL OF MOLECULAR STRUCTURE. Volume: 1031 (2013) - 2013 • 100
Mo(VI)-melamine hybrid as single-source precursor to pure-phase β-Mo2C for the selective hydrogenation of naphthalene to tetralin
Pang, M. and Wang, X. and Xia, W. and Muhler, M. and Liang, C.
INDUSTRIAL AND ENGINEERING CHEMISTRY RESEARCH. Volume: 52 (2013) - 2013 • 99
Carbon dioxide activated carbide-derived carbon monoliths as high performance adsorbents
Oschatz, M. and Borchardt, L. and Senkovska, I. and Klein, N. and Leistner, M. and Kaskel, S.
CARBON. Volume: 56 (2013) - 2013 • 98
Low potential biofuel cell anodes based on redox polymers with covalently bound phenothiazine derivatives for wiring flavin adenine dinucleotide-dependent enzymes
Pöller, S. and Shao, M. and Sygmund, C. and Ludwig, R. and Schuhmann, W.
ELECTROCHIMICA ACTA. Volume: 110 (2013) - 2013 • 97
Experimental and theoretical investigation of molybdenum carbide and nitride as catalysts for ammonia decomposition
Zheng, W. and Cotter, T.P. and Kaghazchi, P. and Jacob, T. and Frank, B. and Schlichte, K. and Zhang, W. and Su, D.S. and Schüth, F. and Schlögl, R.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 135 (2013) - 2013 • 96
Purified oxygen- and nitrogen-modified multi-walled carbon nanotubes as metal-free catalysts for selective olefin hydrogenation
Chen, P. and Chew, L.M. and Kostka, A. and Xie, K. and Muhler, M. and Xia, W.
JOURNAL OF ENERGY CHEMISTRY. Volume: 22 (2013) - 2013 • 95
Control of phase coexistence in calcium tantalate composite photocatalysts for highly efficient hydrogen production
Wang, P. and Chen, P. and Kostka, A. and Marschall, R. and Wark, M.
CHEMISTRY OF MATERIALS. Volume: 25 (2013) - 2013 • 94
Creation of surface defects on carbon nanofibers by steam treatment
Shao, Z. and Pang, M. and Xia, W. and Muhler, M. and Liang, C.
JOURNAL OF ENERGY CHEMISTRY. Volume: 22 (2013) - 2013 • 93
A cryogenically flexible covalent organic framework for efficient hydrogen isotope separation by quantum sieving
Oh, H. and Kalidindi, S.B. and Um, Y. and Bureekaew, S. and Schmid, R. and Fischer, R.A. and Hirscher, M.
ANGEWANDTE CHEMIE - INTERNATIONAL EDITION. Volume: 52 (2013) - 2013 • 92
A thermodynamic approach for the development of austenitic steels with a high resistance to hydrogen gas embrittlement
Martín, M. and Weber, S. and Theisen, W.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY. Volume: 38 (2013) - 2013 • 91
Coupling osmium complexes to epoxy-functionalised polymers to provide mediated enzyme electrodes for glucose oxidation
Ó Conghaile, P. and Pöller, S. and MacAodha, D. and Schuhmann, W. and Leech, D.
BIOSENSORS AND BIOELECTRONICS. Volume: 43 (2013) - 2013 • 90
Development of a stable high-aluminum austenitic stainless steel for hydrogen applications
Martin, M. and Weber, S. and Theisen, W. and Michler, T. and Naumann, J.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY. Volume: 38 (2013) - 2013 • 89
A low-potential glucose biofuel cell anode based on a toluidine blue modified redox polymer and the flavodehydrogenase domain of cellobiose dehydrogenase
Shao, M. and Pöller, S. and Sygmund, C. and Ludwig, R. and Schuhmann, W.
ELECTROCHEMISTRY COMMUNICATIONS. Volume: 29 (2013) - 2012 • 88
Influence of Cs + and Na + on specific adsorption of *oH, *o, and *h at platinum in acidic sulfuric media
Berkes, B.B. and Inzelt, G. and Schuhmann, W. and Bondarenko, A.S.
JOURNAL OF PHYSICAL CHEMISTRY C. Volume: 116 (2012) - 2012 • 87
Optimizing the deposition of hydrogen evolution sites on suspended semiconductor particles using on-line photocatalytic reforming of aqueous methanol solutions
Busser, G.W. and Mei, B. and Muhler, M.
CHEMSUSCHEM. Volume: 5 (2012) - 2012 • 86
β-Fe2 O3 nanomaterials from an iron(ii) diketonate-diamine complex: A study from molecular precursor to growth process
Barreca, D. and Carraro, G. and Devi, A. and Fois, E. and Gasparotto, A. and Seraglia, R. and MacCato, C. and Sada, C. and Tabacchi, G. and Tondello, E. and Venzo, A. and Winter, M.
DALTON TRANSACTIONS. Volume: 41 (2012) - 2012 • 85
Mesoporous nitrogen-rich carbon materials as catalysts for the oxygen reduction reaction in alkaline solution
Nagaiah, T.C. and Bordoloi, A. and Sánchez, M.D. and Muhler, M. and Schuhmann, W.
CHEMSUSCHEM. Volume: 5 (2012) - 2012 • 84
Intestinal aspartate proteases TiCatD and TiCatD2 of the haematophagous bug Triatoma infestans (Reduviidae): Sequence characterisation, expression pattern and characterisation of proteolytic activity
Balczun, C. and Siemanowski, J. and Pausch, J.K. and Helling, S. and Marcus, K. and Stephan, C. and Meyer, H.E. and Schneider, T. and Cizmowski, C. and Oldenburg, M. and Höhn, S. and Meiser, C.K. and Schuhmann, W. and Schaub, G.A.
INSECT BIOCHEMISTRY AND MOLECULAR BIOLOGY. Volume: 42 (2012) - 2012 • 83
Hole Localization and Thermochemistry of Oxidative Dehydrogenation of Aqueous Rutile TiO 2(110)
Cheng, J. and Sulpizi, M. and Vandevondele, J. and Sprik, M.
CHEMCATCHEM. Volume: 4 (2012) - 2012 • 82
NADH oxidation using modified electrodes based on lactate and glucose dehydrogenase entrapped between an electrocatalyst film and redox catalyst-modified polymers
Al-Jawadi, E. and Pöller, S. and Haddad, R. and Schuhmann, W.
MICROCHIMICA ACTA. Volume: 177 (2012) - 2012 • 81
Role of Water in the Chlorine Evolution Reaction at RuO 2-Based Electrodesa-Understanding Electrocatalysis as a Resonance Phenomenon
Zeradjanin, A.R. and Menzel, N. and Strasser, P. and Schuhmann, W.
CHEMSUSCHEM. Volume: 5 (2012) - 2012 • 80
Ab initio study of the interaction of H with substitutional solute atoms in α-Fe: Trends across the transition-metal series
Psiachos, D. and Hammerschmidt, T. and Drautz, R.
COMPUTATIONAL MATERIALS SCIENCE. Volume: 65 (2012) - 2012 • 79
Diffusion of hydrogen within idealized grains of bcc Fe: A kinetic Monte Carlo study
Du, Y.A. and Rogal, J. and Drautz, R.
PHYSICAL REVIEW B - CONDENSED MATTER AND MATERIALS PHYSICS. Volume: 86 (2012) - 2012 • 78
Determination of pre-steady-state rate constants on the escherichia coli pyruvate dehydrogenase complex reveals that loop movement controls the rate-limiting step
Balakrishnan, A. and Nemeria, N.S. and Chakraborty, S. and Kakalis, L. and Jordan, F.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 134 (2012) - 2012 • 77
Hydrogen-induced cracking at grain and twin boundaries in an Fe-Mn-C austenitic steel
Koyama, M. and Akiyama, E. and Sawaguchi, T. and Raabe, D. and Tsuzaki, K.
SCRIPTA MATERIALIA. Volume: 66 (2012) - 2012 • 76
Oxide/water interfaces: How the surface chemistry modifies interfacial water properties
Gaigeot, M.-P. and Sprik, M. and Sulpizi, M.
JOURNAL OF PHYSICS CONDENSED MATTER. Volume: 24 (2012) - 2012 • 75
Non-syngas direct steam reforming of methanol to hydrogen and carbon dioxide at low temperature
Yu, K.M.K. and Tong, W. and West, A. and Cheung, K. and Li, T. and Smith, G. and Guo, Y. and Tsang, S.C.E.
NATURE COMMUNICATIONS. Volume: 3 (2012) - 2012 • 74
Dehydrogenase-Based Reagentless Biosensors: Electrochemically Assisted Deposition of Sol-Gel Thin Films on Functionalized Carbon Nanotubes
Wang, Z. and Etienne, M. and Pöller, S. and Schuhmann, W. and Kohring, G.-W. and Mamane, V. and Walcarius, A.
ELECTROANALYSIS. Volume: 24 (2012) - 2012 • 73
Hydrogen environment embrittlement of stable austenitic steels
Michler, T. and San Marchi, C. and Naumann, J. and Weber, S. and Martin, M.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY. Volume: 37 (2012) - 2012 • 72
Characterization of oxidation and reduction of Pt-Ru and Pt-Rh-Ru alloys by atom probe tomography and comparison with Pt-Rh
Li, T. and Bagot, P.A.J. and Marquis, E.A. and Tsang, S.C.E. and Smith, G.D.W.
JOURNAL OF PHYSICAL CHEMISTRY C. Volume: 116 (2012) - 2012 • 71
Electrochemical quartz crystal microbalance study of the Fe-Ga co-deposition
Iselt, D. and Tschulik, K. and Oswald, S. and Pohl, D. and Schultz, L. and Schlörb, H.
JOURNAL OF THE ELECTROCHEMICAL SOCIETY. Volume: 159 (2012) - 2012 • 70
Characterization of oxidation and reduction of a Palladium-Rhodium alloy by atom-probe tomography
Li, T. and Bagot, P.A.J. and Marquis, E.A. and Tsang, S.C.E. and Smith, G.D.W.
JOURNAL OF PHYSICAL CHEMISTRY C. Volume: 116 (2012) - 2012 • 69
Electrochemical oxidation of size-selected pt nanoparticles studied using in situ high-energy-resolution X-ray absorption spectroscopy
Merte, L.R. and Behafarid, F. and Miller, D.J. and Friebel, D. and Cho, S. and Mbuga, F. and Sokaras, D. and Alonso-Mori, R. and Weng, T.-C. and Nordlund, D. and Nilsson, A. and Roldan Cuenya, B.
ACS CATALYSIS. Volume: 2 (2012) - 2012 • 68
Study on the effects of wet ball milling and boron nitride additive on Li-N-H hydrogen storage system
Du, L. and Mauer, G. and Vaßen, R.
ENERGY PROCEDIA. Volume: 29 (2012) - 2012 • 67
Highly sensitive and selective hydrogen single-nanowire nanosensor
Lupan, O. and Chow, L. and Pauporté, T. and Ono, L.K. and Roldan Cuenya, B. and Chai, G.
SENSORS AND ACTUATORS, B: CHEMICAL. Volume: 173 (2012) - 2012 • 66
Solution enthalpy of hydrogen in fourth row elements: Systematic trends derived from first principles
Aydin, U. and Ismer, L. and Hickel, T. and Neugebauer, J.
PHYSICAL REVIEW B - CONDENSED MATTER AND MATERIALS PHYSICS. Volume: 85 (2012) - 2012 • 65
The Role of Oxygen- and Nitrogen-containing Surface Groups on the Sintering of Iron Nanoparticles on Carbon Nanotubes in Different Atmospheres
Sánchez, M.D. and Chen, P. and Reinecke, T. and Muhler, M. and Xia, W.
CHEMCATCHEM. Volume: 4 (2012) - 2012 • 64
Impact of heat treatment on the mechanical properties of AISI 304L austenitic stainless steel in high-pressure hydrogen gas
Weber, S. and Martin, M. and Theisen, W.
JOURNAL OF MATERIALS SCIENCE. Volume: 47 (2012) - 2012 • 63
Development of lean alloyed austenitic stainless steels with reduced tendency to hydrogen environment embrittlement
Weber, S. and Martin, M. and Theisen, W.
MATERIALS SCIENCE FORUM. Volume: 706-709 (2012) - 2012 • 62
Synthesis, crystal structures, and hydrogen-storage properties of Eu(AlH 4) 2 and Sr(AlH 4) 2 and of their decomposition intermediates, EuAlH 5 and SrAlH 5
Pommerin, A. and Wosylus, A. and Felderhoff, M. and Schüth, F. and Weidenthaler, C.
INORGANIC CHEMISTRY. Volume: 51 (2012) - 2012 • 61
Synthesis, characterization, and hydrogen storage capacities of hierarchical porous carbide derived carbon monolith
Wang, J. and Oschatz, M. and Biemelt, T. and Borchardt, L. and Senkovska, I. and Lohe, M.R. and Kaskel, S.
JOURNAL OF MATERIALS CHEMISTRY. Volume: 22 (2012) - 2012 • 60
Scanning electrochemical microscopy (SECM) in proton exchange membrane fuel cell research and development
Schuhmann, W. and Bron, M.
POLYMER ELECTROLYTE MEMBRANE AND DIRECT METHANOL FUEL CELL TECHNOLOGY: IN SITU CHARACTERIZATION TECHNIQUES FOR LOW TEMPERATURE FUEL CELLS. Volume: (2012) - 2012 • 59
Solid-state nuclear magnetic resonance studies delineate the role of the protein in activation of both aromatic rings of thiamin
Balakrishnan, A. and Paramasivam, S. and Chakraborty, S. and Polenova, T. and Jordan, F.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 134 (2012) - 2012 • 58
Film deposition on the inner surface of tubes using atmospheric-pressure Ar-CH 4, Ar-C 2H 2 and Ar-C 2H 2-H 2 plasmas: Interpretation of film properties from plasma-chemical kinetics
Pothiraja, R. and Engelhardt, M. and Bibinov, N. and Awakowicz, P.
JOURNAL OF PHYSICS D: APPLIED PHYSICS. Volume: 45 (2012) - 2012 • 57
Activated carbon supported molybdenum carbides as cheap and highly efficient catalyst in the selective hydrogenation of naphthalene to tetralin
Pang, M. and Liu, C. and Xia, W. and Muhler, M. and Liang, C.
GREEN CHEMISTRY. Volume: 14 (2012) - 2011 • 56
The oxidation of tyrosine and tryptophan studied by a molecular dynamics normal hydrogen electrode
Costanzo, F. and Sulpizi, M. and Valle, R.G.D. and Sprik, M.
JOURNAL OF CHEMICAL PHYSICS. Volume: 134 (2011) - 2011 • 55
Grain boundary electrochemistry of β-type Nb-Ti alloy using a scanning droplet cell
Woldemedhin, M.T. and Raabe, D. and Hassel, A.W.
PHYSICA STATUS SOLIDI (A) APPLICATIONS AND MATERIALS SCIENCE. Volume: 208 (2011) - 2011 • 54
Plasma-assisted synthesis of Ag/ZnO nanocomposites: First example of photo-induced H2 production and sensing
Simon, Q. and Barreca, D. and Bekermann, D. and Gasparotto, A. and MacCato, C. and Comini, E. and Gombac, V. and Fornasiero, P. and Lebedev, O.I. and Turner, S. and Devi, A. and Fischer, R.A. and Van Tendeloo, G.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY. Volume: 36 (2011) - 2011 • 53
SIMS study on the surface chemistry of stainless steel AISI 304 cylindrical tensile test samples showing hydrogen embrittlement
Izawa, C. and Wagner, S. and Martin, M. and Weber, S. and Bourgeon, A. and Pargeter, R. and Michler, T. and Pundt, A.
JOURNAL OF ALLOYS AND COMPOUNDS. Volume: 509 (2011) - 2011 • 52
Plasma processing of nanomaterials: Emerging technologies for sensing and energy applications
Gasparotto, A. and Barreca, D. and Bekermann, D. and Devi, A. and Fischer, R.A. and MacCato, C. and Tondello, E.
JOURNAL OF NANOSCIENCE AND NANOTECHNOLOGY. Volume: 11 (2011) - 2011 • 51
Evolution of the structure and chemical state of Pd nanoparticles during the in situ catalytic reduction of NO with H2
Paredis, K. and Ono, L.K. and Behafarid, F. and Zhang, Z. and Yang, J.C. and Frenkel, A.I. and Cuenya, B.R.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 133 (2011) - 2011 • 50
Chemical compounds for energy storage
Schüth, F.
CHEMIE-INGENIEUR-TECHNIK. Volume: 83 (2011) - 2011 • 49
Synthesis and hydriding/dehydriding properties of Mg2Ni-AB (AB = TiNi or TiFe) nanocomposites
Zlatanova, Z. and Spassov, T. and Eggeler, G. and Spassova, M.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY. Volume: 36 (2011) - 2011 • 48
Ab initio study of the modification of elastic properties of α-iron by hydrostatic strain and by hydrogen interstitials
Psiachos, D. and Hammerschmidt, T. and Drautz, R.
ACTA MATERIALIA. Volume: 59 (2011) - 2011 • 47
F-doped Co3O4 photocatalysts for sustainable H 2 generation from water/ethanol
Gasparotto, A. and Barreca, D. and Bekermann, D. and Devi, A. and Fischer, R.A. and Fornasiero, P. and Gombac, V. and Lebedev, O.I. and MacCato, C. and Montini, T. and Van Tendeloo, G. and Tondello, E.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 133 (2011) - 2011 • 46
Wiring photosynthetic enzymes to electrodes
Badura, A. and Kothe, T. and Schuhmann, W. and Rögner, M.
ENERGY AND ENVIRONMENTAL SCIENCE. Volume: 4 (2011) - 2011 • 45
The influence of the potassium promoter on the kinetics and thermodynamics of CO adsorption on a bulk iron catalyst applied in Fischer-Tropsch synthesis: A quantitative adsorption calorimetry, temperature-programmed desorption, and surface hydrogenation study
Graf, B. and Muhler, M.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS. Volume: 13 (2011) - 2011 • 44
Hydrogen storage properties of nanostructured MgH2/TiH 2 composite prepared by ball milling under high hydrogen pressure
Shao, H. and Felderhoff, M. and Schüth, F.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY. Volume: 36 (2011) - 2011 • 43
Effect of boron on the fracture behavior and grain boundary chemistry of Ni3Fe
Liu, Y. and Liu, C.T. and Heatherly, L. and George, E.P.
SCRIPTA MATERIALIA. Volume: 64 (2011) - 2011 • 42
Hydrogen production from formic acid decomposition at room temperature using a Ag-Pd core-shell nanocatalyst
Tedsree, K. and Li, T. and Jones, S. and Chan, C.W.A. and Yu, K.M.K. and Bagot, P.A.J. and Marquis, E.A. and Smith, G.D.W. and Tsang, S.C.E.
NATURE NANOTECHNOLOGY. Volume: 6 (2011) - 2011 • 41
Effect of alloying elements on hydrogen environment embrittlement of AISI type 304 austenitic stainless steel
Martin, M. and Weber, S. and Theisen, W. and Michler, T. and Naumann, J.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY. Volume: 36 (2011) - 2011 • 40
Amorphous carbon film deposition on the inner surface of tubes using atmospheric pressure pulsed filamentary plasma source
Pothiraja, R. and Bibinov, N. and Awakowicz, P.
JOURNAL OF PHYSICS D: APPLIED PHYSICS. Volume: 44 (2011) - 2011 • 39
Lean-alloyed austenitic stainless steel with high resistance against hydrogen environment embrittlement
Weber, S. and Martin, M. and Theisen, W.
MATERIALS SCIENCE AND ENGINEERING A. Volume: 528 (2011) - 2011 • 38
Nanostructured Ti-catalyzed MgH2 for hydrogen storage
Shao, H. and Felderhoff, M. and Schüth, F. and Weidenthaler, C.
NANOTECHNOLOGY. Volume: 22 (2011) - 2011 • 37
Influence of machining-induced martensite on hydrogen-assisted fracture of AISI type 304 austenitic stainless steel
Martin, M. and Weber, S. and Izawa, C. and Wagner, S. and Pundt, A. and Theisen, W.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY. Volume: 36 (2011) - 2011 • 36
Scanning electrochemical microscopy for investigation of multicomponent bioelectrocatalytic films
Dobrzeniecka, A. and Zeradjanin, A. and Masa, J. and Stroka, J. and Goral, M. and Schuhmann, W. and Kulesza, P.J.
ECS TRANSACTIONS. Volume: 35 (2011) - 2011 • 35
HT-PEM fuel cell system with integrated complex metal hydride storage tank
Urbanczyk, R. and Peil, S. and Bathen, D. and Heßke, C. and Burfeind, J. and Hauschild, K. and Felderhoff, M. and Schüth, F.
FUEL CELLS. Volume: 11 (2011) - 2011 • 34
Transport spectroscopy of non-equilibrium many-particle spin states in self-assembled quantum dots
Marquardt, B. and Geller, M. and Baxevanis, B. and Pfannkuche, D. and Wieck, A.D. and Reuter, D. and Lorke, A.
NATURE COMMUNICATIONS. Volume: 2 (2011) - 2011 • 33
Sterilization of heat-sensitive silicone implant material by low-pressure gas plasma
Hauser, J. and Esenwein, S.-A. and Awakowicz, P. and Steinau, H.-U. and Köller, M. and Halfmann, H.
BIOMEDICAL INSTRUMENTATION AND TECHNOLOGY. Volume: 45 (2011) - 2011 • 32
Local electrocatalytic induction of sol-gel deposition at Pt nanoparticles
Schwamborn, S. and Etienne, M. and Schuhmann, W.
ELECTROCHEMISTRY COMMUNICATIONS. Volume: 13 (2011) - 2010 • 31
Influence of the ball milling conditions on the preparation of rare earth aluminum hydrides
Pommerin, A. and Felderhoff, M. and Schüth, F. and Weidenthaler, C.
SCRIPTA MATERIALIA. Volume: 63 (2010) - 2010 • 30
Accessing ultrashort reaction times in particle formation with SAXS experiments: ZnS precipitation on the microsecond time scale
Schmidt, W. and Bussian, P. and Lindén, M. and Amenitsch, H. and Agren, P. and Tiemann, M. and Schüth, F.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 132 (2010) - 2010 • 29
Enhanced neovascularization of dermis substitutes via low-pressure plasma-mediated surface activation
Ring, A. and Langer, S. and Schaffran, A. and Stricker, I. and Awakowicz, P. and Steinau, H.-U. and Hauser, J.
BURNS. Volume: 36 (2010) - 2010 • 28
Ab initio study of the solubility and kinetics of hydrogen in austenitic high Mn steels
Ismer, L. and Hickel, T. and Neugebauer, J.
PHYSICAL REVIEW B - CONDENSED MATTER AND MATERIALS PHYSICS. Volume: 81 (2010) - 2010 • 27
From glycerol to allyl alcohol: Iron oxide catalyzed dehydration and consecutive hydrogen transfer
Liu, Y. and Tüysüz, H. and Jia, C.-J. and Schwickardi, M. and Rinaldi, R. and Lu, A.-H. and Schmidt, W. and Schüth, F.
CHEMICAL COMMUNICATIONS. Volume: 46 (2010) - 2010 • 26
Carbon-stabilized mesoporous MoS2 - Structural and surface characterization with spectroscopic and catalytic tools
Polyakov, M. and Poisot, M. and Van Den Berg, M.W.E. and Drescher, T. and Lotnyk, A. and Kienle, L. and Bensch, W. and Muhler, M. and Grünert, W.
CATALYSIS COMMUNICATIONS. Volume: 12 (2010) - 2010 • 25
First-row transition metal catalyzed reduction of carbonyl functionalities: A mechanistic perspective
Chakraborty, S. and Guan, H.
DALTON TRANSACTIONS. Volume: 39 (2010) - 2010 • 24
First-principles study of the thermodynamics of hydrogen-vacancy interaction in fcc iron
Nazarov, R. and Hickel, T. and Neugebauer, J.
PHYSICAL REVIEW B - CONDENSED MATTER AND MATERIALS PHYSICS. Volume: 82 (2010) - 2010 • 23
Carbon nanotube-supported sulfided Rh catalysts for the oxygen reduction reaction
Jin, C. and Xia, W. and Guo, J. and Nagaiah, T.C. and Bron, M. and Schuhmann, W. and Muhler, M.
STUDIES IN SURFACE SCIENCE AND CATALYSIS. Volume: 175 (2010) - 2010 • 22
Native and hydrogen-containing point defects in Mg3 N 2: A density functional theory study
Lange, B. and Freysoldt, C. and Neugebauer, J.
PHYSICAL REVIEW B - CONDENSED MATTER AND MATERIALS PHYSICS. Volume: 81 (2010) - 2010 • 21
Hydrogen Loading of Oxide Powder Particles: A Transmission IR Study for the Case of Zinc Oxide
Noei, H. and Qiu, H. and Wang, Y. and Muhler, M. and Wöll, C.
CHEMPHYSCHEM. Volume: 11 (2010) - 2010 • 20
Solving the structure of size-selected Pt nanocatalysts synthesized by inverse micelle encapsulation
Roldan Cuenya, B. and Croy, J.R. and Mostafa, S. and Behafarid, F. and Li, L. and Zhang, Z. and Yang, J.C. and Wang, Q. and Frenkel, A.I.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 132 (2010) - 2010 • 19
Hydrogen adsorption on polar ZnO(0001)-Zn: Extending equilibrium surface phase diagrams to kinetically stabilized structures
Valtiner, M. and Todorova, M. and Neugebauer, J.
PHYSICAL REVIEW B - CONDENSED MATTER AND MATERIALS PHYSICS. Volume: 82 (2010) - 2010 • 18
Shearforce-based constant-distance scanning electrochemical microscopy as fabrication tool for needle-type carbon-fiber nanoelectrodes
Hussien, E.M. and Schuhmann, W. and Schulte, A.
ANALYTICAL CHEMISTRY. Volume: 82 (2010) - 2010 • 17
1D ZnO nano-assemblies by Plasma-CVD as chemical sensors for flammable and toxic gases
Barreca, D. and Bekermann, D. and Comini, E. and Devi, A. and Fischer, R.A. and Gasparotto, A. and MacCato, C. and Sberveglieri, G. and Tondello, E.
SENSORS AND ACTUATORS, B: CHEMICAL. Volume: 149 (2010) - 2010 • 16
An integrated catalytic approach to fermentable sugars from cellulose
Rinaldi, R. and Engel, P. and Büchs, J. and Spiess, A.C. and Schüth, F.
CHEMSUSCHEM. Volume: 3 (2010) - 2010 • 15
Ordered mesoporous carbide derived carbons for high pressure gas storage
Kockrick, E. and Schrage, C. and Borchardt, L. and Klein, N. and Rose, M. and Senkovska, I. and Kaskel, S.
CARBON. Volume: 48 (2010) - 2010 • 14
Direct synthesis of pure complex aluminium hydrides by cryomilling
Pommerin, A. and Weidenthaler, C. and Schüth, F. and Felderhoff, M.
SCRIPTA MATERIALIA. Volume: 62 (2010) - 2010 • 13
Redox electrodeposition polymers: Adaptation of the redox potential of polymer-bound Os complexes for bioanalytical applications
Guschin, D.A. and Castillo, J. and Dimcheva, N. and Schuhmann, W.
ANALYTICAL AND BIOANALYTICAL CHEMISTRY. Volume: 398 (2010) - 2010 • 12
Acidity constants from DFT-based molecular dynamics simulations
Sulpizi, M. and Sprik, M.
JOURNAL OF PHYSICS CONDENSED MATTER. Volume: 22 (2010) - 2010 • 11
Modeling size effects on fracture toughness by dislocation dynamics
Zeng, X.H. and Hartmaier, A.
ACTA MATERIALIA. Volume: 58 (2010) - 2009 • 10
Comparison of single- and multiobjective design of experiment in combinatorial chemistry for the selective dehydrogenation of propane
Llamas-Galilea, J. and Gobin, O.C. and Schüth, F.
JOURNAL OF COMBINATORIAL CHEMISTRY. Volume: 11 (2009) - 2009 • 9
Membrane-Less Biofuel Cell Based on Cellobiose Dehydrogenase (Anode)/Laccase (Cathode) Wired via Specific Os-Redox Polymers
Stoica, L. and Dimcheva, N. and Ackermann, Y. and Karnicka, K. and Guschin, D.A. and Kulesza, P.J. and Rogalski, J. and Haltrich, D. and Ludwig, R. and Gorton, L. and Schuhmann, W.
FUEL CELLS. Volume: 9 (2009) - 2009 • 8
Cycling properties of Sc- and Ce-doped NaAlH4 hydrogen storage materials prepared by the one-step direct synthesis method
Bogdanović, B. and Felderhoff, M. and Pommerin, A. and Schüth, F. and Spielkamp, N. and Stark, A.
JOURNAL OF ALLOYS AND COMPOUNDS. Volume: 471 (2009) - 2009 • 7
Chemical and physical solutions for hydrogen storage
Eberle, U. and Felderhoff, M. and Schüth, F.
ANGEWANDTE CHEMIE - INTERNATIONAL EDITION. Volume: 48 (2009) - 2009 • 6
Catalytic hydrogenations of tolane and stilbene with Ti- and Ce-doped complex metal hydrides
Streukens, G. and Schüth, F.
JOURNAL OF ALLOYS AND COMPOUNDS. Volume: 474 (2009) - 2009 • 5
Kinetics and particle size effects in ethene hydrogenation over supported palladium catalysts at atmospheric pressure
Binder, A. and Seipenbusch, M. and Muhler, M. and Kasper, G.
JOURNAL OF CATALYSIS. Volume: 268 (2009) - 2009 • 4
Complex rare-earth aluminum hydrides: Mechanochemical preparation, crystal structure and potential for hydrogen storage
Weidenthaler, C. and Pommerin, A. and Felderhoff, M. and Sun, W. and Wolverton, C. and Bogdanović, B. and Schüth, F.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 131 (2009) - 2009 • 3
Redox potentials and pKa for benzoquinone from density functional theory based molecular dynamics
Cheng, J. and Sulpizi, M. and Sprik, M.
JOURNAL OF CHEMICAL PHYSICS. Volume: 131 (2009) - 2009 • 2
The electron attachment energy of the aqueous hydroxyl radical predicted from the detachment energy of the aqueous hydroxide anion
Adriaanse, C. and Sulpizi, M. and VandeVondele, J. and Sprik, M.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. Volume: 131 (2009) - 2009 • 1
Challenges in hydrogen storage
Schüth, F.
EUROPEAN PHYSICAL JOURNAL: SPECIAL TOPICS. Volume: 176 (2009)