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1252 Publications


2022 | Journal Article | LibreCat-ID: 36874
Su, Jiangling, Alejandro González Orive, and Guido Grundmeier. “Nano-FTIR and Chemical Force Analysis of Electrografted Aryldiazonium Salts on ODT-Microcontact Printed Au-Surfaces.” Applied Surface Science 609 (2022). https://doi.org/10.1016/j.apsusc.2022.155355.
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2022 | Journal Article | LibreCat-ID: 36872
Bobzin, K., C. Kalscheuer, Guido Grundmeier, T. de los Arcos, S. Kollmann, and M. Carlet. “Oxidation Stability of Chromium Aluminum Oxynitride Hard Coatings.” Surface and Coatings Technology 449 (2022). https://doi.org/10.1016/j.surfcoat.2022.128927.
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2022 | Journal Article | LibreCat-ID: 36873
Neßlinger, Vanessa, Stefan Welzel, Florian Rieker, Dennis Meinderink, Ulrich Nieken, and Guido Grundmeier. “Thin Organic‐Inorganic Anti‐Fouling Hybrid‐Films for Microreactor Components.” Macromolecular Reaction Engineering, 2022. https://doi.org/10.1002/mren.202200043.
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2022 | Journal Article | LibreCat-ID: 36804
Henksmeier, Tobias, Johann Friedemann Schulz, Elias Kluth, Martin Feneberg, Rüdiger Goldhahn, Ana M. Sanchez, Markus Voigt, Guido Grundmeier, and Dirk Reuter. “Remote Epitaxy of In(x)Ga(1-x)As(001) on Graphene Covered GaAs(001) Substrates.” Journal of Crystal Growth 593 (2022). https://doi.org/10.1016/j.jcrysgro.2022.126756.
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2022 | Journal Article | LibreCat-ID: 35977
Hoppe, Christian, Felix Mitschker, Lukas Mai, Maciej Oskar Liedke, Maria Teresa de los Arcos de Pedro, Peter Awakowicz, Anjana Devi, et al. “Influence of Surface Activation on the Microporosity of PE‐CVD and PE‐ALD SiO                          x                        Thin Films on PDMS.” Plasma Processes and Polymers 19, no. 4 (2022). https://doi.org/10.1002/ppap.202100174.
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2022 | Journal Article | LibreCat-ID: 35976
Arcos de Pedro, Maria Teresa de los, Christian Weinberger, Frederik Zysk, Varun Raj Damerla, Sabrina Kollmann, Pascal Vieth, Michael Tiemann, Thomas D. Kühne, and Guido Grundmeier. “Challenges in the Interpretation of Gas Core Levels for the Determination of Gas-Solid Interactions within Dielectric Porous Films by Ambient Pressure XPS.” Applied Surface Science 604 (2022). https://doi.org/10.1016/j.apsusc.2022.154525.
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2022 | Journal Article | LibreCat-ID: 35974
Xie, Xiaofan, Maria Teresa de los Arcos de Pedro, and Guido Grundmeier. “Comparative Analysis of Hexamethyldisiloxane and Hexamethyldisilazane Plasma Polymer Thin Films before and after Plasma Oxidation.” Plasma Processes and Polymers 19, no. 11 (2022). https://doi.org/10.1002/ppap.202200052.
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2022 | Journal Article | LibreCat-ID: 37942
Andexer, Jennifer N., Uwe Beifuss, Malte Brasholz, Rolf Breinbauer, Martin Breugst, Oliver Dumele, Martin Ernst, et al. “Trendbericht Organische Chemie 2022.” Nachrichten Aus Der Chemie 70, no. 3 (2022): 42–69. https://doi.org/10.1002/nadc.20224122453.
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2022 | Journal Article | LibreCat-ID: 37938
Terazzi, Constanza, Karoline Laatz, Jan von Langermann, and Thomas Werner. “Synthesis of Cyclic Carbonates Catalyzed by CaI2–Et3N and Studies on Their Biocatalytic Kinetic Resolution.” ACS Sustainable Chemistry and Engineering 10, no. 40 (2022): 13335–42. https://doi.org/10.1021/acssuschemeng.2c03210.
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2022 | Journal Article | LibreCat-ID: 37940
Ren, Changyue, Anke Spannenberg, and Thomas Werner. “Synthesis of Bifunctional Phosphonium Salts Bearing Perfluorinated Side Chains and Their Application in the Synthesis of Cyclic Carbonates from Epoxides and CO            2.” Asian Journal of Organic Chemistry 11, no. 9 (2022). https://doi.org/10.1002/ajoc.202200156.
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2022 | Journal Article | LibreCat-ID: 35703
Hou, Peng, Sebastian Peschtrich, Nils Huber, Wolfram Feuerstein, Angela Bihlmeier, Ivo Krummenacher, Roland Schoch, Wim Klopper, Frank Breher, and Jan Paradies. “Cover Feature: Impact of Heterocycle Annulation on NIR Absorbance in Quinoid Thioacene Derivatives (Chem. Eur. J. 23/2022).” Chemistry – A European Journal 28, no. 23 (2022). https://doi.org/10.1002/chem.202200982.
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2022 | Journal Article | LibreCat-ID: 40984
Feng, Yanyue, Andreas Schaefer, Anders Hellman, Mengqiao Di, Hanna Härelind, Matthias Bauer, and Per-Anders Carlsson. “Synthesis and Characterization of Catalytically Active Au Core─Pd Shell Nanoparticles Supported on Alumina.” Langmuir 38, no. 42 (2022): 12859–70. https://doi.org/10.1021/acs.langmuir.2c01834.
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2022 | Journal Article | LibreCat-ID: 40993
Wissel, Kerstin, Fabio Bernardini, Heesu Oh, Sami Vasala, Roland Schoch, Björn Blaschkowski, Pieter Glatzel, Matthias Bauer, Oliver Clemens, and Andrés Cano. “Single-Layer T′ Nickelates: Synthesis of the La and Pr Members and Electronic Properties across the Rare-Earth Series.” Chemistry of Materials 34, no. 16 (2022): 7201–9. https://doi.org/10.1021/acs.chemmater.2c00726.
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2022 | Journal Article | LibreCat-ID: 40985
Moll, Johannes, Robert Naumann, Lukas Sorge, Christoph Förster, Niklas Gessner, Lukas Burkhardt, Naz Ugur, et al. “Pseudo‐Octahedral Iron(II) Complexes with Near‐Degenerate Charge Transfer and Ligand Field States at the Franck‐Condon Geometry.” Chemistry – A European Journal 28, no. 57 (2022). https://doi.org/10.1002/chem.202201858.
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2022 | Dissertation | LibreCat-ID: 41008
Dierks, Philipp. Synthesis and Characterization of Multichromophoric Iron(II) Complexes as Novel Photosensitizers, 2022. https://doi.org/10.17619/UNIPB/1-1558.
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2022 | Dissertation | LibreCat-ID: 41014
Huber-Gedert, Marina. Base Metal Iron(II)-Cobalt(III) Dyads for Photocatalytic Hydrogen Evolution, 2022.
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2022 | Journal Article | LibreCat-ID: 36425
Dogan, Deniz, Simon Ruthmann, Oliver Seewald, and Wolfgang Bremser. “Tuning of Antifouling Active PDMS Domains Tethered to Epoxy/Amine Surface.” Progress in Organic Coatings 170 (2022). https://doi.org/10.1016/j.porgcoat.2022.106977.
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2022 | Journal Article | LibreCat-ID: 41810
Torkaman, Najmeh Filvan, Marina Kley, Wolfgang Bremser, and René Wilhelm. “Reversible Functionalization and Exfoliation of Graphite by a Diels–Alder Reaction with Furfuryl Amine.” RSC Advances 12, no. 27 (2022): 17249–56. https://doi.org/10.1039/d2ra02566c.
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2022 | Journal Article | LibreCat-ID: 33687
Odziomek, Mateusz, Paolo Giusto, Janina Kossmann, Nadezda V. Tarakina, Julian Joachim Heske, Salvador M. Rivadeneira, Waldemar Keil, et al. “‘Red Carbon’: A Rediscovered Covalent Crystalline Semiconductor.” Advanced Materials 34, no. 40 (2022). https://doi.org/10.1002/adma.202206405.
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2022 | Journal Article | LibreCat-ID: 41649
Büngeler, Anne, Fabian Kollmann, Klaus Huber, and Oliver I. Strube. “Targeted Synthesis of the Type-A Particle Substructure from Enzymatically Produced Eumelanin.” Biomacromolecules 23, no. 3 (2022): 1020–29. https://doi.org/10.1021/acs.biomac.1c01390.
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2022 | Journal Article | LibreCat-ID: 29790 | OA
Kothe, Linda, Maximilian Albert, Cedrik Meier, Thorsten Wagner, and Michael Tiemann. “Stimulation and Enhancement of Near‐Band‐Edge Emission in Zinc Oxide by Distributed Bragg Reflectors.” Advanced Materials Interfaces, 2022. https://doi.org/10.1002/admi.202102357.
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2022 | Journal Article | LibreCat-ID: 35707 | OA
Javed, Ali, Felix Steinke, Stephan Wöhlbrandt, Hana Bunzen, Norbert Stock, and Michael Tiemann. “The Role of Sulfonate Groups and Hydrogen Bonding in the Proton Conductivity of Two Coordination Networks.” Beilstein Journal of Nanotechnology 13 (2022): 437–43. https://doi.org/10.3762/bjnano.13.36.
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2022 | Journal Article | LibreCat-ID: 33691
Arcos, Teresa de los, Christian Weinberger, Frederik Zysk, Varun Raj Damerla, Sabrina Kollmann, Pascal Vieth, Michael Tiemann, Thomas Kühne, and Guido Grundmeier. “Challenges in the Interpretation of Gas Core Levels for the Determination of Gas-Solid Interactions within Dielectric Porous Films by Ambient Pressure XPS.” Applied Surface Science 604 (2022). https://doi.org/10.1016/j.apsusc.2022.154525.
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2022 | Journal Article | LibreCat-ID: 33685 | OA
Weinberger, Christian, Frederik Zysk, Marc Hartmann, Naveen Kaliannan, Waldemar Keil, Thomas Kühne, and Michael Tiemann. “The Structure of Water in Silica Mesopores – Influence of the Pore Wall Polarity.” Advanced Materials Interfaces 9, no. 20 (2022). https://doi.org/10.1002/admi.202200245.
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2022 | Journal Article | LibreCat-ID: 29376
Wortmann, Martin, Waldemar Keil, Bennet Brockhagen, Jan Biedinger, Michael Westphal, Christian Weinberger, Elise Diestelhorst, et al. “Pyrolysis of Sucrose-Derived Hydrochar.” Journal of Analytical and Applied Pyrolysis 161 (2022). https://doi.org/10.1016/j.jaap.2021.105404.
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2022 | Journal Article | LibreCat-ID: 28254 | OA
Geromel, René, Christian Weinberger, Katja Brormann, Michael Tiemann, and Thomas Zentgraf. “Porous SiO2 Coated Dielectric Metasurface with Consistent Performance Independent of Environmental Conditions.” Optical Materials Express 12, no. 1 (2022): 13–21. https://doi.org/10.1364/ome.444264.
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2022 | Journal Article | LibreCat-ID: 33965 | OA
Bocchini, Adriana, Uwe Gerstmann, Tim Bartley, Hans-Georg Steinrück, Gerald Henkel, and Wolf Gero Schmidt. “Electrochemical Performance of KTiOAsO_4 (KTA) in Potassium-Ion Batteries from Density-Functional Theory.” Phys. Rev. Materials 6 (2022): 105401. https://doi.org/10.1103/PhysRevMaterials.6.105401.
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2022 | Journal Article | LibreCat-ID: 40154
Krüger, Jan Tobias, Kay-Peter Hoyer, Jingyuan Huang, Viviane Filor, Rafael Hernan Mateus-Vargas, Hilke Oltmanns, Jessica Meißner, Guido Grundmeier, and Mirko Schaper. “FeMn with Phases of a Degradable Ag Alloy for Residue-Free and Adapted Bioresorbability.” Journal of Functional Biomaterials 13, no. 4 (2022): 185. https://doi.org/10.3390/jfb13040185.
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2022 | Journal Article | LibreCat-ID: 34652
Vieth, P., M.-A. Garthe, Dietrich Voswinkel, Mirko Schaper, and Guido Grundmeier. “Enhancement of the Delamination Resistance of Adhesive Film Coated Surface Laser Melted Aluminum 7075-T6 Alloy by Aminophosphonic Acid Adsorption.” Surface and Coatings Technology 447 (2022). https://doi.org/10.1016/j.surfcoat.2022.128835.
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2022 | Journal Article | LibreCat-ID: 30103
Huang, Jingyuan, Alejandro Gonzalez Orive, Jan Tobias Krüger, Kay-Peter Hoyer, Adrian Keller, and Guido Grundmeier. “Influence of Proteins on the Corrosion of a Conventional and Selective Laser Beam Melted FeMn Alloy in Physiological Electrolytes.” Corrosion Science 200 (2022): 110186. https://doi.org/10.1016/j.corsci.2022.110186.
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2022 | Journal Article | LibreCat-ID: 34654
Kusoglu, Ihsan Murat, Pascal Vieth, Steffen Heiland, Florian Huber, Arne Lüddecke, Anna Rosa Ziefuss, Arno Kwade, et al. “Microstructure and Corrosion Properties of PBF-LB Produced Carbide Nanoparticles Additivated AlSi10Mg Parts.” Procedia CIRP 111 (2022): 10–13. https://doi.org/10.1016/j.procir.2022.08.046.
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2022 | Conference Abstract | LibreCat-ID: 44376
Tonbul, Güldeniz, Julian Kappler, Saravanakumar Murugan, Roland Schoch, Michal Nowakowski, Pia Lange, Matthias Bauer, and Michael R. Buchmeiser. “Development of Battery System Based on Na-S and Characterization Using X-Ray Absorption Spectroscopy.” Edinburgh, 2022.
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2022 | Journal Article | LibreCat-ID: 45007
Yang, Y., J. Cheramy, Martin Brehm, and Y. Xu. “Raman Optical Activity of N-Acetyl-L-Cysteine in Water and in Methanol: The ‘Clusters-in-a-Liquid’ Model and Ab Initio Molecular Dynamics Simulations.” ChemPhysChem 23 (11) (2022): e202200161. https://doi.org/10.1002/cphc.202200161.
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2022 | Journal Article | LibreCat-ID: 45010
Chahal, R., S. Roy, Martin Brehm, S. Banerjee, V. Bryantsev, and S. Lam. “Transferable Deep Learning Potential Reveals Intermediate-Range Ordering Effects in LiF–NaF–ZrF4 Molten Salt.” JACS Au 2 (12) (2022): 2693–2702. https://doi.org/10.1021/jacsau.2c00526.
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2022 | Journal Article | LibreCat-ID: 45008
Taherivardanjani, S., J. Blasius, Martin Brehm, R. Dötzer, and B. Kirchner. “Conformer Weighting and Differently Sized Cluster Weighting for Nicotine and Its Phosphorus Derivatives.” J. Phys. Chem. A 126 (40) (2022): 7070–83. https://doi.org/10.1021/acs.jpca.2c03133.
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2022 | Journal Article | LibreCat-ID: 45009
Frömbgen, T., J. Blasius, V. Alizadeh, A. Chaumont, Martin Brehm, and B. Kirchner. “Cluster Analysis in Liquids: A Novel Tool in TRAVIS.” J. Chem. Inf. Model. 62 (22) (2022): 5634–44. https://doi.org/10.1021/acs.jcim.2c01244.
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2022 | Journal Article | LibreCat-ID: 33834
Mathieson, Angus G. M., Wesley M. Dose, Hans-Georg Steinrück, Christopher J. Takacs, Sascha Feldmann, Raj Pandya, Alice J. Merryweather, et al. “A Mechanistic Study of the Dopant-Induced Breakdown in Halide Perovskites Using Solid State Energy Storage Devices.” Energy & Environmental Science 15, no. 10 (2022): 4323–37. https://doi.org/10.1039/d2ee01754g.
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2022 | Preprint | LibreCat-ID: 32404
Kühne, Thomas, Christian Plessl, Robert Schade, and Ole Schütt. “CP2K on the Road to Exascale.” ArXiv:2205.14741, 2022.
LibreCat | Download (ext.) | arXiv
 

2022 | Journal Article | LibreCat-ID: 33684 | OA
Schade, Robert, Tobias Kenter, Hossam Elgabarty, Michael Lass, Ole Schütt, Alfio Lazzaro, Hans Pabst, et al. “Towards Electronic Structure-Based Ab-Initio Molecular Dynamics Simulations with Hundreds of Millions of Atoms.” Parallel Computing 111 (2022). https://doi.org/10.1016/j.parco.2022.102920.
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2022 | Journal Article | LibreCat-ID: 46479
Bobzin, K., C. Kalscheuer, Guido Grundmeier, S. Kollmann, M. Carlet, and Maria Teresa de los Arcos de Pedro. “Oxidation Stability of Chromium Aluminum Oxynitride Hard Coatings.” Surface and Coatings Technology 449 (2022). https://doi.org/10.1016/j.surfcoat.2022.128927.
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2022 | Conference Paper | LibreCat-ID: 35830
Elsner, Julia, Claudia Tenberge, and Sabine Fechner. “Modeling-Based Learning about Chemical Phenomena in Primary Education.” In Fostering Scientific Citizenship in an Uncertain World (Proceedings of ESERA 2021), edited by Graça S. Carvalho, Ana Sofia Afonso, and Zélia Anastácio, 1241–49. Braga: CIEC, University of Minho, n.d.
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2022 | Conference Paper | LibreCat-ID: 33559
Elsner, Julia, Claudia Tenberge, and Sabine Fechner. “Analogien zur Förderung schülerseitigen Modellierens im Sachunterricht.” In Unsicherheit als Element von naturwissenschaftsbezogenen Bildungsprozessen, edited by Sebastian Habig and Helena van Vorst, 42:500–503, 2022.
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2022 | Journal Article | LibreCat-ID: 40987
Schlicher, Steffen, Nils Prinz, Julius Bürger, Andreas Omlor, Christian Singer, Mirijam Zobel, Roland Schoch, et al. “Quality or Quantity? How Structural Parameters Affect Catalytic Activity of Iron Oxides for CO Oxidation.” Catalysts 12, no. 6 (2022). https://doi.org/10.3390/catal12060675.
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2022 | Journal Article | LibreCat-ID: 43021
Duderija, B., A. González-Orive, H.C. Schmidt, J.C. Calderón, I. Hordych, H.J. Maier, W. Homberg, and G. Grundmeier. “Electrografting of BTSE: Zn Films for Advanced Steel-Aluminum Joining by Plastic Deformation.” Journal of Advanced Joining Processes 7 (2022). https://doi.org/10.1016/j.jajp.2022.100137.
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2022 | Journal Article | LibreCat-ID: 32283
Schmolke, Tobias, Gerson Meschut, Florian Rieker, Dennis Meinderink, and Guido Grundmeier. “Untersuchung von Klebverbindungen für Batteriegehäuse.” adhäsion KLEBEN & DICHTEN 66 (2022): 40–43. https://doi.org/10.1007/s35145-022-0596-9.
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2022 | Journal Article | LibreCat-ID: 40986
Nowakowski, Michał, Aleksandr Kalinko, Jakub Szlachetko, Rafał Fanselow, and Matthias Bauer. “High Resolution off Resonant Spectroscopy as a Probe of the Oxidation State.” Journal of Analytical Atomic Spectrometry 37, no. 11 (2022): 2383–91. https://doi.org/10.1039/d2ja00232a.
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2022 | Journal Article | LibreCat-ID: 40988
Weber, Sebastian, Ronny T. Zimmermann, Jens Bremer, Ken L. Abel, David Poppitz, Nils Prinz, Jan Ilsemann, et al. “Digitization in Catalysis Research: Towards a Holistic Description of a Ni/Al2O3 Reference Catalyst for CO2 Methanation.” ChemCatChem 14, no. 8 (2022). https://doi.org/10.1002/cctc.202101878.
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2021 | Book Chapter | LibreCat-ID: 24935 | OA
Bauer, Anna, Marc Sacher, Sebastian Habig, and Sabine Fechner. “Laborpraktika auf Distanz. Ansätze in den Naturwissenschaften.” In Hochschule auf Abstand. Ein multiperspektivischer Zugang zur digitalen Lehre, edited by Iris Neiske, Judith Osthushenrich, Niclas Schaper, Ulrike Trier, and Nerea Vöing, 3:155–68. Hochschulbildung: Lehre und Forschung. Bielefeld: transcript Verlag, 2021.
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2021 | Journal Article | LibreCat-ID: 25182
Zhang, Yong, Gang Wan, Nicholas H. C. Lewis, Julian Mars, Sharon E. Bone, Hans-Georg Steinrück, Maria R. Lukatskaya, et al. “Water or Anion? Uncovering the Zn2+ Solvation Environment in Mixed Zn(TFSI)2 and LiTFSI Water-in-Salt Electrolytes.” ACS Energy Letters 6 (2021): 3458–63. https://doi.org/10.1021/acsenergylett.1c01624.
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2021 | Journal Article | LibreCat-ID: 25183
Geise, Natalie R., Robert M. Kasse, Johanna Nelson Weker, Hans-Georg Steinrück, and Michael F. Toney. “Quantification of Efficiency in Lithium Metal Negative Electrodes via Operando X-Ray Diffraction.” Chemistry of Materials 33 (2021): 7537–45. https://doi.org/10.1021/acs.chemmater.1c02585.
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