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1483 Publications
2021 | Journal Article | LibreCat-ID: 25896
R. Tischendorf et al., “Examination of the evolution of iron oxide nanoparticles in flame spray pyrolysis by tailored in situ particle sampling techniques,” Journal of Aerosol Science, Art. no. 105722, 2021, doi: 10.1016/j.jaerosci.2020.105722.
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 22635
J. A. Garcia Diosa et al., “TiO2 nanoparticle coatings on glass surfaces for the selective trapping of leukemia cells from peripheral blood,” Journal of Biomedical Materials Research Part B: Applied Biomaterials, vol. 109, pp. 2142–2153, 2021, doi: 10.1002/jbm.b.34862.
LibreCat
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2021 | Journal Article | LibreCat-ID: 25892
F. Steinke, A. Javed, S. Wöhlbrandt, M. Tiemann, and N. Stock, “New isoreticular phosphonate MOFs based on a tetratopic linker,” Dalton Transactions, pp. 13572–13579, 2021, doi: 10.1039/d1dt02610k.
LibreCat
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2021 | Journal Article | LibreCat-ID: 39653
C. Wiebeler, J. Vollbrecht, A. Neuba, H.-S. Kitzerow, and S. Schumacher, “Unraveling the electrochemical and spectroscopic properties of neutral and negatively charged perylene tetraethylesters,” Scientific Reports, vol. 11, no. 1, Art. no. 16097, 2021, doi: 10.1038/s41598-021-95551-0.
LibreCat
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2021 | Journal Article | LibreCat-ID: 45001
E. Roos and M. Brehm, “A Force Field for Bio-Polymers in Ionic Liquids (BILFF) – Part 1: [EMIm][OAc] / Water Mixtures,” Phys. Chem. Chem. Phys., vol. 23, pp. 1242–1253, 2021, doi: 10.1039/D0CP04537C.
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 45004
M. Brehm and M. Thomas, “Optimized Atomic Partial Charges and Radii Defined by Radical Voronoi Tessellation of Bulk Phase Simulations,” Molecules, vol. 26 (7), p. 1875, 2021, doi: 10.3390/molecules26071875.
LibreCat
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2021 | Journal Article | LibreCat-ID: 45005
S. Roy et al., “Unraveling Local Structure of Molten Salts via X-Ray Scattering, Raman Spectroscopy, and ab initio Molecular Dynamics,” J. Phys. Chem. B, vol. 125 (22), pp. 5971–5982, 2021, doi: 10.1021/acs.jpcb.1c03786.
LibreCat
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2021 | Journal Article | LibreCat-ID: 45006
A. Triolo et al., “Liquid Structure and Dynamics in the Choline Acetate:Urea 1:2 Deep Eutectic Solvent,” J. Chem. Phys., vol. 154, p. 244501, 2021, doi: 10.1063/5.0054048.
LibreCat
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2021 | Journal Article | LibreCat-ID: 45003
M.-A. Codescu, M. Weiß, M. Brehm, O. Kornilov, D. Sebastiani, and E. T. J. Nibbering, “Switching Between Proton Vacancy and Excess Proton Transfer Pathways in the Reaction Between 7-Hydroxyquinoline and Formate,” J. Phys. Chem. A, vol. 125 (9), pp. 1845–1859, 2021, doi: 10.1021/acs.jpca.0c10191.
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 45000
M. Mukherjee, D. Tripathi, M. Brehm, C. Riplinger, and A. K. Dutta, “Efficient EOM-CC-Based Protocol for the Calculation of Electron Affinity of Solvated Nucleobases: Uracil as a Case Study,” J. Chem. Theory Comput., vol. 17 (1), pp. 105–116, 2021, doi: 10.1021/acs.jctc.0c00655.
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 45002
A. Triolo, F. L. Celso, M. Brehm, V. D. Lisio, and O. Russina, “Liquid Structure of a Choline Chloride-Water Natural Deep Eutectic Solvent: A Molecular Dynamics Characterization,” J. Mol. Liq., vol. 331, p. 115750, 2021, doi: 10.1016/j.molliq.2021.115750.
LibreCat
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2021 | Journal Article | LibreCat-ID: 24566 | 
K. Engelkemeier, A. Sun, D. Voswinkel, O. Grydin, M. Schaper, and W. Bremser, “Zinc Anodizing: Structural Diversity of Anodic Zinc Oxide Controlled by the Type of Electrolyte,” ChemElectroChem, pp. 2155–2168, 2021, doi: 10.1002/celc.202100216.
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2021 | Conference Paper | LibreCat-ID: 33545
J. Elsner, C. Tenberge, and S. Fechner, “Unterstützung des Modellierungsprozesses durch Analogiebildung im Sachunterricht,” in Naturwissenschaftlicher Unterricht und Lehrerbildung im Umbruch?, 2021, vol. 41, pp. 609–612.
LibreCat
2021 | Book Chapter | LibreCat-ID: 29936
A. Ramaswami, T. Kenter, T. Kühne, and C. Plessl, “Evaluating the Design Space for Offloading 3D FFT Calculations to an FPGA for High-Performance Computing,” in Applied Reconfigurable Computing. Architectures, Tools, and Applications, Cham: Springer International Publishing, 2021.
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 41007
P. Dierks et al., “Distinct photodynamics of κ-N and κ-C pseudoisomeric iron(ii) complexes,” Chemical Communications, vol. 57, no. 54, pp. 6640–6643, 2021, doi: 10.1039/d1cc01716k.
LibreCat
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2021 | Journal Article | LibreCat-ID: 59620
T. Rust, D. Jung, A. Hoppe, T. Schoppa, K. Langer, and D. Kuckling, “Backbone-Degradable (Co-)Polymers for Light-Triggered Drug Delivery,” ACS Applied Polymer Materials, vol. 3, no. 8, pp. 3831–3842, 2021, doi: 10.1021/acsapm.1c00411.
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2021 | Journal Article | LibreCat-ID: 22859
R. Grothe, J. A. Striewe, D. Meinderink, T. Tröster, and G. Grundmeier, “Enhanced corrosion resistance of adhesive/galvanised steel interfaces by nanocrystalline ZnO thin film deposition and molecular adhesion promoting films,” The Journal of Adhesion, 2021, doi: 10.1080/00218464.2021.1957676.
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 37947
J. Paradies et al., “Organische Chemie,” Nachrichten aus der Chemie, vol. 69, no. 3, pp. 38–68, 2021, doi: 10.1002/nadc.20214105947.
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 37950
Y. Hu et al., “Catalytic, Kinetic, and Mechanistic Insights into the Fixation of CO2 with Epoxides Catalyzed by Phenol‐Functionalized Phosphonium Salts,” ChemSusChem, vol. 14, no. 1, pp. 363–372, 2021, doi: 10.1002/cssc.202002267.
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 37946
T. Werner, A. Grandane, L. Pudnika, I. Domraceva, and R. Zalubovskis, “Base-Free Catalytic Wittig-/Cross-Coupling Reaction Sequence as Short Synthetic Strategy for the Preparation of Highly Functionalized Arylbenzoxepinones,” Synthesis, vol. 53, no. 19, pp. 3545–3554, 2021, doi: 10.1055/a-1509-6078.
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