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1493 Publications
2021 | Book Chapter | LibreCat-ID: 24935 | 
Bauer, A., Sacher, M., Habig, S., & Fechner, S. (2021). Laborpraktika auf Distanz. Ansätze in den Naturwissenschaften. In I. Neiske, J. Osthushenrich, N. Schaper, U. Trier, & N. Vöing (Eds.), Hochschule auf Abstand. Ein multiperspektivischer Zugang zur digitalen Lehre (Vol. 3, pp. 155–168). transcript Verlag. https://doi.org/DOI: 10.14361/9783839456903-011
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2021 | Journal Article | LibreCat-ID: 62851
Schnaars, K., Kaneko, M., & Fujisawa, K. (2021). Effect of Oxygen-Donor Charge on Adjacent Nitrogen-Donor Interactions in Eu3+ Complexes of Mixed N,O-Donor Ligands Demonstrated on a 10-Fold [Eu(TPAMEN)]3+ Chelate Complex. Inorganic Chemistry, 60(4), 2477–2491. https://doi.org/10.1021/acs.inorgchem.0c03405
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2021 | Conference Abstract | LibreCat-ID: 62965
Pollmeier, P. (2021). Epistemological enhancement through confrontation with anomalous data. Summerschool of The European Science Education Research Association, digital.
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2021 | Conference Abstract | LibreCat-ID: 62960
Pollmeier, P. (2021). Epistemological enhancement t hrough confrontation with anomalous data. Summerschool of The European Science Education Research Association, digital.
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2021 | Conference Paper | LibreCat-ID: 23758 |
Peeters, H., Habig, S., & Fechner, S. (2021). Augmented Reality als Experimentierhilfe bei Beobachtung und Deutung. In S. Habig (Ed.), Naturwissenschaftlicher Unterricht und Lehrerbildung im Umbruch? (Vol. 41, pp. 613–616).
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2021 | Journal Article | LibreCat-ID: 64895
Paradies, J., Andexer, J., Beifuss, U., Beuerle, F., Brasholz, M., Breinbauer, R., Ernst, M., Ganardi, R., Gulder, T. A. M., Hüttel, W., Kath‐Schorr, S., Körber, K., Kordes, M., Lehmann, M., Lindel, T., Luy, B., Mück‐Lichtenfeld, C., Muhle‐Goll, C., Niemeyer, J., … Winter, C. (2021). Organische Chemie. Nachrichten Aus Der Chemie, 69(3), 38–68. https://doi.org/10.1002/nadc.20214105947
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2021 | Journal Article | LibreCat-ID: 65632
Zhuravlev, E., Milkereit, B., Yang, B., Heiland, S., Vieth, P., Voigt, M., Schaper, M., Grundmeier, G., Schick, C., & Kessler, O. (2021). Assessment of AlZnMgCu alloy powder modification for crack-free laser powder bed fusion by differential fast scanning calorimetry. Materials & Design, 204, Article 109677. https://doi.org/10.1016/j.matdes.2021.109677
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2020 | Journal Article | LibreCat-ID: 25301
Scherer, B., Kottenstedde, I. L., Bremser, W., & Matysik, F.-M. (2020). Analytical characterization of polyamide 11 used in the context of selective laser sintering: Physico-chemical correlations. Polymer Testing, Article 106786. https://doi.org/10.1016/j.polymertesting.2020.106786
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2020 | Journal Article | LibreCat-ID: 19679
Ojha, D., & Kühne, T. D. (2020). “On-The-Fly” Calculation of the Vibrational Sum-Frequency Generation Spectrum at the Air-Water Interface. Molecules, 25. https://doi.org/10.3390/molecules25173939
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2020 | Journal Article | LibreCat-ID: 19680
Kühne, T., Heske, J. J., & Prodan, E. (2020). Disordered crystals from first principles II: Transport coefficients. Annals of Physics, 421, 168290. https://doi.org/10.1016/j.aop.2020.168290
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2020 | Journal Article | LibreCat-ID: 19681
Salem, M. A., & Kühne, T. D. (2020). Insight from energy decomposition analysis on a hydrogen-bond-mediated mechanism for on-water catalysis. Molecular Physics, 1–6. https://doi.org/10.1080/00268976.2020.1797920
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2020 | Journal Article | LibreCat-ID: 19823
Elizabeth, A., Conradi, H., K. Sahoo, S., Kodalle, T., A. Kaufmann, C., Kühne, T., … Mönig, H. (2020). Correlating facet orientation, defect-level density and dipole layer formation at the surface of polycrystalline CuInSe2 thin films. Acta Materialia, 200. https://doi.org/10.1016/j.actamat.2020.09.028
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2020 | Journal Article | LibreCat-ID: 21239
Sahoo, S. K., Heske, J. J., Antonietti, M., Qin, Q., Oschatz, M., & Kühne, T. (2020). Electrochemical N2 Reduction to Ammonia Using Single Au/Fe Atoms Supported on Nitrogen-Doped Porous Carbon. ACS Applied Energy Materials, 3(10), 10061–10069. https://doi.org/10.1021/acsaem.0c01740
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2020 | Journal Article | LibreCat-ID: 17375
Zhou, J., Khazaei, M., Ranjbar, A., Wang, V., Kühne, T. D., Ohno, K., … Liang, Y. (2020). Modulation of nearly free electron states in hydroxyl-functionalized MXenes: a first-principles study. J. Mater. Chem. C, 8, 5211–5221. https://doi.org/10.1039/C9TC06837F
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2020 | Journal Article | LibreCat-ID: 17379
Kumar Sahoo, S., Heske, J. J., Azadi, S., Zhang, Z., V Tarakina, Nadezda , Oschatz, M., … Kühne, T. (2020). On the Possibility of Helium Adsorption in Nitrogen Doped Graphitic Materials. Scientific Reports, 10(1). https://doi.org/10.1038/s41598-020-62638-z
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2020 | Journal Article | LibreCat-ID: 17381
Elgabarty, H., Kampfrath, T., Bonthuis, D. J., Balos, V., Kaliannan, N. K., Loche, P., … Sajadi, M. (2020). Energy transfer within the hydrogen bonding network of water following resonant terahertz excitation. Science Advances, 6(17). https://doi.org/10.1126/sciadv.aay7074
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2020 | Journal Article | LibreCat-ID: 17386
Kühne, T. D., Iannuzzi, M., Del Ben, M., Rybkin, V. V., Seewald, P., Stein, F., … al., et. (2020). CP2K: An electronic structure and molecular dynamics software package - Quickstep: Efficient and accurate electronic structure calculations. The Journal of Chemical Physics, 152(19), 194103. https://doi.org/10.1063/5.0007045
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2020 | Journal Article | LibreCat-ID: 23599
Savikhin, V., Steinrück, H.-G., Liang, R.-Z., Collins, B. A., Oosterhout, S. D., Beaujuge, P. M., & Toney, M. F. (2020). GIWAXS-SIIRkit: scattering intensity, indexing and refraction calculation toolkit for grazing-incidence wide-angle X-ray scattering of organic materials. Journal of Applied Crystallography, 53, 1108–1129. https://doi.org/10.1107/s1600576720005476
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2020 | Journal Article | LibreCat-ID: 23600
Gebers, J., Özen, B., Hartmann, L., Schaer, M., Suàrez, S., Bugnon, P., Scopelliti, R., Steinrück, H.-G., Konovalov, O., Magerl, A., Brinkmann, M., Petraglia, R., Silva, P., Corminboeuf, C., & Frauenrath, H. (2020). Crystallization and Organic Field‐Effect Transistor Performance of a Hydrogen‐Bonded Quaterthiophene. Chemistry – A European Journal, 26, 10265–10275. https://doi.org/10.1002/chem.201904562
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2020 | Journal Article | LibreCat-ID: 23601
Abdelsamie, M., Xu, J., Bruening, K., Tassone, C. J., Steinrück, H.-G., & Toney, M. F. (2020). Impact of Processing on Structural and Compositional Evolution in Mixed Metal Halide Perovskites during Film Formation. Advanced Functional Materials, 30, 2001752. https://doi.org/10.1002/adfm.202001752
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