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166 Publications


2022 | Journal Article | LibreCat-ID: 44231
D. Schleier, M. Gerlach, D. Schaffner, D. P. Mukhopadhyay, P. Hemberger, and I. Fischer, “Threshold photoelectron spectroscopy of trimethylborane and its pyrolysis products,” Physical Chemistry Chemical Physics, vol. 25, no. 6, pp. 4511–4518, 2022, doi: 10.1039/d2cp04513c.
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2022 | Journal Article | LibreCat-ID: 40988
S. Weber et al., “Digitization in Catalysis Research: Towards a Holistic Description of a Ni/Al2O3 Reference Catalyst for CO2 Methanation,” ChemCatChem, vol. 14, no. 8, 2022, doi: 10.1002/cctc.202101878.
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2021 | Journal Article | LibreCat-ID: 30208
H. T. Do, P. Franke, S. Volpert, M. Klinksiek, M. Thome, and C. Held, “Measurement and modelling solubility of amino acids and peptides in aqueous 2-propanol solutions,” Physical Chemistry Chemical Physics, vol. 23, no. 18, pp. 10852–10863, 2021, doi: 10.1039/d1cp00005e.
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2021 | Journal Article | LibreCat-ID: 31022
M. S. A. Abdelaty and D. Kuckling, “Altering of lower critical solution temperature of environmentally responsive poly (N-isopropylacrylamide-co-acrylic acid-co-vanillin acrylate) affected by acrylic acid, vanillin acrylate, and post-polymerization modification,” Colloid and Polymer Science, vol. 299, no. 10, pp. 1617–1629, 2021, doi: 10.1007/s00396-021-04882-x.
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2021 | Journal Article | LibreCat-ID: 33644
S. Pylaeva, P. Marx, G. Singh, T. Kühne, M. Roemelt, and H. Elgabarty, “Organic Mixed-Valence Compounds and the Overhauser Effect in Insulating Solids,” The Journal of Physical Chemistry A, vol. 125, no. 3, pp. 867–874, 2021, doi: 10.1021/acs.jpca.0c11296.
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2021 | Journal Article | LibreCat-ID: 33648
A. Ghasemi and T. Kühne, “Artificial neural networks for the kinetic energy functional of non-interacting fermions,” The Journal of Chemical Physics, vol. 154, no. 7, Art. no. 074107, 2021, doi: 10.1063/5.0037319.
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2021 | Journal Article | LibreCat-ID: 33651
S. K. Sahoo et al., “Photocatalytic Water Splitting Reaction Catalyzed by Ion-Exchanged Salts of Potassium Poly(heptazine imide) 2D Materials,” The Journal of Physical Chemistry C, vol. 125, no. 25, pp. 13749–13758, 2021, doi: 10.1021/acs.jpcc.1c03947.
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2021 | Journal Article | LibreCat-ID: 35687
R. Zhou and J. Paradies, “Borane Catalyzed Redox Isomerization of 2‐Amino Chalcones: Hydride Abstraction or Hydride Migration?,” European Journal of Organic Chemistry, vol. 2021, no. 46, pp. 6334–6339, 2021, doi: 10.1002/ejoc.202100883.
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2021 | Journal Article | LibreCat-ID: 40433
C.-D. Dong and S. Schumacher, “Microscopic Insights into Charge Formation and Energetics in n-Doped Organic Semiconductors,” The Journal of Physical Chemistry C, vol. 125, no. 40, pp. 21824–21830, 2021, doi: 10.1021/acs.jpcc.1c05666.
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2021 | Journal Article | LibreCat-ID: 41324
S. Maier et al., “Immobilized Platinum Hydride Species as Catalysts for Olefin Isomerizations and Enyne Cycloisomerizations,” Organometallics, vol. 40, no. 11, pp. 1751–1757, 2021, doi: 10.1021/acs.organomet.1c00216.
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2021 | Journal Article | LibreCat-ID: 41002
H.-H. Nguyen et al., “Probing the Interactions of Immobilized Ruthenium Dihydride Complexes with Metal Oxide Surfaces by MAS NMR: Effects on CO2 Hydrogenation,” The Journal of Physical Chemistry C, vol. 125, no. 27, pp. 14627–14635, 2021, doi: 10.1021/acs.jpcc.1c02074.
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2021 | Journal Article | LibreCat-ID: 41012
M. Winkler et al., “Electronic Structure of a Diiron Complex: A Multitechnique Experimental Study of [(dppf)Fe(CO) 3]+/0,” Inorganic Chemistry, vol. 60, no. 5, pp. 2856–2865, 2021, doi: 10.1021/acs.inorgchem.0c03259.
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2021 | Journal Article | LibreCat-ID: 41326
K. Wojtaszek et al., “Determination of Crystal-Field Splitting Induced by Thermal Oxidation of Titanium,” The Journal of Physical Chemistry A, vol. 125, no. 1, pp. 50–56, 2021, doi: 10.1021/acs.jpca.0c07955.
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2021 | Journal Article | LibreCat-ID: 35326
W. Keil, K. Zhao, A. Oswald, W. Bremser, C. Schmidt, and H. Hintze-Bruening, “Thermostable water reservoirs in the interlayer space of a sodium hectorite clay through the intercalation of γ-aminopropyl(dimethyl)ethoxysilane in toluene,” Physical Chemistry Chemical Physics, vol. 24, no. 1, pp. 477–487, 2021, doi: 10.1039/d1cp03321b.
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2021 | Journal Article | LibreCat-ID: 29748
D. Slawig, M. Gruschwitz, U. Gerstmann, E. Rauls, and C. Tegenkamp, “Adsorption and Reaction of PbPc on Hydrogenated Epitaxial Graphene,” The Journal of Physical Chemistry C, vol. 125, no. 36, pp. 20087–20093, 2021, doi: 10.1021/acs.jpcc.1c06320.
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2021 | Journal Article | LibreCat-ID: 32240
R. S. Chatwell, G. Guevara-Carrion, Y. Gaponenko, V. Shevtsova, and J. Vrabec, “Diffusion of the carbon dioxide–ethanol mixture in the extended critical region,” Physical Chemistry Chemical Physics, vol. 23, no. 4, pp. 3106–3115, 2021, doi: 10.1039/d0cp04985a.
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2021 | Journal Article | LibreCat-ID: 41009
S. Maier et al., “Immobilized Platinum Hydride Species as Catalysts for Olefin Isomerizations and Enyne Cycloisomerizations,” Organometallics, vol. 40, no. 11, pp. 1751–1757, 2021, doi: 10.1021/acs.organomet.1c00216.
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2020 | Journal Article | LibreCat-ID: 32246
H. Mirhosseini, R. Kormath Madam Raghupathy, S. K. Sahoo, H. Wiebeler, M. Chugh, and T. D. Kühne, “In silico investigation of Cu(In,Ga)Se2-based solar cells,” Physical Chemistry Chemical Physics, vol. 22, no. 46, pp. 26682–26701, 2020, doi: 10.1039/d0cp04712k.
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2020 | Journal Article | LibreCat-ID: 34301
H. Elgabarty and T. Kühne, “Tumbling with a limp: local asymmetry in water’s hydrogen bond network and its consequences,” Physical Chemistry Chemical Physics, vol. 22, no. 19, pp. 10397–10411, 2020, doi: 10.1039/c9cp06960g.
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2020 | Journal Article | LibreCat-ID: 32491
S. A. Trubachev et al., “The effect of triphenyl phosphate inhibition on flame propagation over cast PMMA slabs,” Proceedings of the Combustion Institute, vol. 38, no. 3, pp. 4635–4644, 2020, doi: 10.1016/j.proci.2020.05.043.
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