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1462 Publications
2021 | Journal Article | LibreCat-ID: 31022
Abdelaty MSA, Kuckling D. 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. 2021;299(10):1617-1629. doi:10.1007/s00396-021-04882-x
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 31019
Watt FA, Sieland B, Dickmann N, et al. Coupling of CO2 and epoxides catalysed by novel N-fused mesoionic carbene complexes of nickel(<scp>ii</scp>). Dalton Transactions. 2021;50(46):17361-17371. doi:10.1039/d1dt03311e
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 23702
Schmiegel CJ, Berg P, Obst F, Schoch R, Appelhans D, Kuckling D. Continuous Flow Synthesis of Azoxybenzenes by Reductive Dimerization of Nitrosobenzenes with Gel‐Bound Catalysts. European Journal of Organic Chemistry. 2021;(11):1628-1636. doi:10.1002/ejoc.202100006
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 23696
Jung D, Rust T, Völlmecke K, Schoppa T, Langer K, Kuckling D. Backbone vs. side-chain: two light-degradable polyurethanes based on 6-nitropiperonal. Polymer Chemistry. 2021;12:4565-4575. doi:10.1039/d1py00442e
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 23698
Rodin M, Li J, Kuckling D. Dually cross-linked single networks: structures and applications. Chemical Society Reviews. 2021;50:8147-8177. doi:10.1039/d0cs01585g
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 33653
Gurinov A, Sieland B, Kuzhelev A, et al. Mixed‐Valence Compounds as Polarizing Agents for Overhauser Dynamic Nuclear Polarization in Solids. Angewandte Chemie International Edition. 2021;60(28):15371-15375. doi:10.1002/anie.202103215
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 34647
Brögelmann T, Bobzin K, Grundmeier G, et al. Durability of nanolayer Ti–Al–O–N hard coatings under simulated polycarbonate melt processing conditions. Journal of Physics D: Applied Physics. 2021;55(3). doi:10.1088/1361-6463/ac2e31
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 34645
Tripathi TS, Wilken M, Hoppe C, et al. Atomic Layer Deposition of Copper Metal Films from Cu(acac) 2 and Hydroquinone Reductant. Advanced Engineering Materials. 2021;23(10). doi:10.1002/adem.202100446
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 29699
Ghasemi SA, Kühne TD. Artificial neural networks for the kinetic energy functional of non-interacting fermions. The Journal of Chemical Physics. 2021;154(7):074107. doi:10.1063/5.0037319
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 33587
Ranjbar A, Mirhosseini H, Kühne TD. On topological materials as photocatalysts for water splitting by visible light. Journal of Physics: Materials. 2021;5(1). doi:10.1088/2515-7639/ac363d
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 33643
Heske JJ, Walczak R, Epping JD, et al. When water becomes an integral part of carbon – combining theory and experiment to understand the zeolite-like water adsorption properties of porous C2N materials. Journal of Materials Chemistry A. 2021;9(39):22563-22572. doi:10.1039/d1ta05122a
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 33645
Ojha D, Kühne T. Hydrogen bond dynamics of interfacial water molecules revealed from two-dimensional vibrational sum-frequency generation spectroscopy. Scientific Reports. 2021;11(1). doi:10.1038/s41598-021-81635-4
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 33644
Pylaeva S, Marx P, Singh G, Kühne T, Roemelt M, Elgabarty H. Organic Mixed-Valence Compounds and the Overhauser Effect in Insulating Solids. The Journal of Physical Chemistry A. 2021;125(3):867-874. doi:10.1021/acs.jpca.0c11296
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 33649
Kessler J, Calcavecchia F, Kühne T. Artificial Neural Networks as Trial Wave Functions for Quantum Monte Carlo. Advanced Theory and Simulations. 2021;4(4). doi:10.1002/adts.202000269
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 33648
Ghasemi A, Kühne T. Artificial neural networks for the kinetic energy functional of non-interacting fermions. The Journal of Chemical Physics. 2021;154(7). doi:10.1063/5.0037319
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 33655
Chugh M, Jain M, Wang G, Nia AS, Mirhosseini H, Kühne T. A combinatorial study of electrochemical anion intercalation into graphite. Materials Research Express. 2021;8(8). doi:10.1088/2053-1591/ac1965
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 33658
Partovi-Azar P, Kühne T. Full Assignment of Ab-Initio Raman Spectra at Finite Temperatures Using Wannier Polarizabilities: Application to Cyclohexane Molecule in Gas Phase. Micromachines. 2021;12(10). doi:10.3390/mi12101212
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 33651
Sahoo SK, Teixeira IF, Naik A, et al. Photocatalytic Water Splitting Reaction Catalyzed by Ion-Exchanged Salts of Potassium Poly(heptazine imide) 2D Materials. The Journal of Physical Chemistry C. 2021;125(25):13749-13758. doi:10.1021/acs.jpcc.1c03947
LibreCat
| DOI
2021 | Journal Article | LibreCat-ID: 33657
Mirhosseini H, Tahmasbi H, Kuchana SR, Ghasemi A, Kühne T. An automated approach for developing neural network interatomic potentials with FLAME. Computational Materials Science. 2021;197. doi:10.1016/j.commatsci.2021.110567
LibreCat
| DOI
2021 | Conference Paper | LibreCat-ID: 33654
Balos V, Elgabarty H, Wolf M, et al. Ultrafast solvent-to-solvent and solvent-to-solute energy transfer driven by single-cycle THz electric fields. In: Razeghi M, Baranov AN, eds. Terahertz Emitters, Receivers, and Applications XII. SPIE; 2021. doi:10.1117/12.2594143
LibreCat
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