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1483 Publications
2022 | Journal Article | LibreCat-ID: 30103
J. Huang, A. G. Orive, J. T. Krüger, K.-P. Hoyer, A. Keller, and G. Grundmeier, “Influence of proteins on the corrosion of a conventional and selective laser beam melted FeMn alloy in physiological electrolytes,” Corrosion Science, vol. 200, p. 110186, 2022, doi: 10.1016/j.corsci.2022.110186.
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2022 | Journal Article | LibreCat-ID: 34654
I. M. Kusoglu et al., “Microstructure and corrosion properties of PBF-LB produced carbide nanoparticles additivated AlSi10Mg parts,” Procedia CIRP, vol. 111, pp. 10–13, 2022, doi: 10.1016/j.procir.2022.08.046.
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2022 | Conference Abstract | LibreCat-ID: 44376
G. Tonbul et al., “Development of Battery System Based on Na-S and Characterization Using X-ray Absorption Spectroscopy,” presented at the Electrochem2022 & 63rd Corrosion Science Symposium, Edinburgh, 2022.
LibreCat
2022 | Journal Article | LibreCat-ID: 45007
Y. Yang, J. Cheramy, M. 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, vol. 23 (11), p. e202200161, 2022, doi: 10.1002/cphc.202200161.
LibreCat
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2022 | Journal Article | LibreCat-ID: 45010
R. Chahal, S. Roy, M. 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, vol. 2 (12), pp. 2693–2702, 2022, doi: 10.1021/jacsau.2c00526.
LibreCat
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2022 | Journal Article | LibreCat-ID: 45008
S. Taherivardanjani, J. Blasius, M. Brehm, R. Dötzer, and B. Kirchner, “Conformer Weighting and Differently Sized Cluster Weighting for Nicotine and its Phosphorus Derivatives,” J. Phys. Chem. A, vol. 126 (40), pp. 7070–7083, 2022, doi: 10.1021/acs.jpca.2c03133.
LibreCat
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2022 | Journal Article | LibreCat-ID: 45009
T. Frömbgen, J. Blasius, V. Alizadeh, A. Chaumont, M. Brehm, and B. Kirchner, “Cluster Analysis in Liquids: A Novel Tool in TRAVIS,” J. Chem. Inf. Model., vol. 62 (22), pp. 5634–5644, 2022, doi: 10.1021/acs.jcim.2c01244.
LibreCat
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2022 | Journal Article | LibreCat-ID: 33834
A. G. M. Mathieson et al., “A mechanistic study of the dopant-induced breakdown in halide perovskites using solid state energy storage devices,” Energy & Environmental Science, vol. 15, no. 10, pp. 4323–4337, 2022, doi: 10.1039/d2ee01754g.
LibreCat
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2022 | Preprint | LibreCat-ID: 32404
T. Kühne, C. Plessl, R. Schade, and O. Schütt, “CP2K on the road to exascale,” arXiv:2205.14741. 2022.
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2022 | Journal Article | LibreCat-ID: 33684 | 
R. Schade et al., “Towards electronic structure-based ab-initio molecular dynamics simulations with hundreds of millions of atoms,” Parallel Computing, vol. 111, Art. no. 102920, 2022, doi: 10.1016/j.parco.2022.102920.
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2022 | Journal Article | LibreCat-ID: 46479
K. Bobzin, C. Kalscheuer, G. Grundmeier, S. Kollmann, M. Carlet, and M. T. de los Arcos de Pedro, “Oxidation stability of chromium aluminum oxynitride hard coatings,” Surface and Coatings Technology, vol. 449, Art. no. 128927, 2022, doi: 10.1016/j.surfcoat.2022.128927.
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2022 | Conference Paper | LibreCat-ID: 33559
J. Elsner, C. Tenberge, and S. Fechner, “Analogien zur Förderung schülerseitigen Modellierens im Sachunterricht,” in Unsicherheit als Element von naturwissenschaftsbezogenen Bildungsprozessen, 2022, vol. 42, pp. 500–503.
LibreCat
2022 | Journal Article | LibreCat-ID: 40987
S. Schlicher et al., “Quality or Quantity? How Structural Parameters Affect Catalytic Activity of Iron Oxides for CO Oxidation,” Catalysts, vol. 12, no. 6, Art. no. 675, 2022, doi: 10.3390/catal12060675.
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2022 | Journal Article | LibreCat-ID: 59617 |
K. Völlmecke et al., “Hydrogel-Based Biosensors,” Gels, vol. 8, no. 12, Art. no. 768, 2022, doi: 10.3390/gels8120768.
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2022 | Journal Article | LibreCat-ID: 59619 |
B. Sieland, A. Hoppe, A. J. Stepen, and J. Paradies, “Frustrated Lewis Pair‐Catalyzed Hydroboration of Nitriles: FLP Versus Borenium Catalysis,” Advanced Synthesis & Catalysis, vol. 364, no. 18, pp. 3143–3148, 2022, doi: 10.1002/adsc.202200525.
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2022 | Journal Article | LibreCat-ID: 29790 |
L. Kothe, M. Albert, C. Meier, T. Wagner, and M. Tiemann, “Stimulation and Enhancement of Near‐Band‐Edge Emission in Zinc Oxide by Distributed Bragg Reflectors,” Advanced Materials Interfaces, vol. 9, Art. no. 2102357, 2022, doi: 10.1002/admi.202102357.
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2022 | Journal Article | LibreCat-ID: 58571
D. Dogan, S. Ruthmann, O. Seewald, and W. Bremser, “Tuning of antifouling active PDMS domains tethered to epoxy/amine surface,” Progress in Organic Coatings, vol. 170, Art. no. 106977, 2022, doi: 10.1016/j.porgcoat.2022.106977.
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2022 | Journal Article | LibreCat-ID: 33687
M. Odziomek et al., “‘Red Carbon’: A Rediscovered Covalent Crystalline Semiconductor,” Advanced Materials, vol. 34, no. 40, Art. no. 2206405, 2022, doi: 10.1002/adma.202206405.
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2022 | Journal Article | LibreCat-ID: 37942
J. N. Andexer et al., “Trendbericht Organische Chemie 2022,” Nachrichten aus der Chemie, vol. 70, no. 3, pp. 42–69, 2022, doi: 10.1002/nadc.20224122453.
LibreCat
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2022 | Journal Article | LibreCat-ID: 37938
C. Terazzi, K. Laatz, J. von Langermann, and T. Werner, “Synthesis of Cyclic Carbonates Catalyzed by CaI2–Et3N and Studies on Their Biocatalytic Kinetic Resolution,” ACS Sustainable Chemistry and Engineering, vol. 10, no. 40, pp. 13335–13342, 2022, doi: 10.1021/acssuschemeng.2c03210.
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