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1497 Publications
2018 | Journal Article | LibreCat-ID: 13405
Impact of finite-temperature and condensed-phase effects on theoretical X-ray absorption spectra of transition metal complexes
P. Müller, K. Karhan, M. Krack, U. Gerstmann, W.G. Schmidt, M. Bauer, T.D. Kühne, Journal of Computational Chemistry (2018) 712–716.
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| DOI
P. Müller, K. Karhan, M. Krack, U. Gerstmann, W.G. Schmidt, M. Bauer, T.D. Kühne, Journal of Computational Chemistry (2018) 712–716.
2018 | Journal Article | LibreCat-ID: 44989
Nanoscopic Structures and Molecular Interactions Leading to a Dystectic and two Eutectic Points in [EMIm][Cl] / Urea Mixtures
U. Cerajewski, J. Träger, S. Henkel, A.H. Roos, M. Brehm, D. Hinderberger, Phys. Chem. Chem. Phys. 20 (2018) 29591–29600.
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U. Cerajewski, J. Träger, S. Henkel, A.H. Roos, M. Brehm, D. Hinderberger, Phys. Chem. Chem. Phys. 20 (2018) 29591–29600.
2018 | Journal Article | LibreCat-ID: 44986
Structure and Lifetimes in Ionic Liquids and their Mixtures
S. Gehrke, M. von Domaros, R. Clark, O. Hollóczki, M. Brehm, T. Welton, A. Luzar, B. Kirchner, Faraday Discuss. 206 (2018) 219–245.
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S. Gehrke, M. von Domaros, R. Clark, O. Hollóczki, M. Brehm, T. Welton, A. Luzar, B. Kirchner, Faraday Discuss. 206 (2018) 219–245.
2018 | Journal Article | LibreCat-ID: 44988
Salt Bridge in Aqueous Solution: Strong Structural Motifs but Weak Enthalpic Effects
S. Pylaeva, M. Brehm, D. Sebastiani, Sci. Rep. 8 (2018) 13626.
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| DOI
S. Pylaeva, M. Brehm, D. Sebastiani, Sci. Rep. 8 (2018) 13626.
2018 | Journal Article | LibreCat-ID: 44990
An Efficient Lossless Compression Algorithm for Trajectories of Atom Positions and Volumetric Data
M. Brehm, M. Thomas, J. Chem. Inf. Model. 58 (10) (2018) 2092–2107.
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| DOI
M. Brehm, M. Thomas, J. Chem. Inf. Model. 58 (10) (2018) 2092–2107.
2018 | Journal Article | LibreCat-ID: 44987
Simulating Structure and Dynamics in Small Droplets of 1-Ethyl-3-Methylimidazolium Acetate
M. Brehm, D. Sebastiani, J. Chem. Phys. 148 (2018) 193802.
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M. Brehm, D. Sebastiani, J. Chem. Phys. 148 (2018) 193802.
2018 | Journal Article | LibreCat-ID: 25911
Graphene oxide as flexibilizer for epoxy amine resins
A. Wolk, M. Rosenthal, J. Weiß, M. Voigt, J.-N. Wesendahl, M. Hartmann, G. Grundmeier, R. Wilhelm, G. Meschut, M. Tiemann, W. Bremser, Progress in Organic Coatings (2018) 280–289.
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A. Wolk, M. Rosenthal, J. Weiß, M. Voigt, J.-N. Wesendahl, M. Hartmann, G. Grundmeier, R. Wilhelm, G. Meschut, M. Tiemann, W. Bremser, Progress in Organic Coatings (2018) 280–289.
2018 | Conference Paper | LibreCat-ID: 1590
A Massively Parallel Algorithm for the Approximate Calculation of Inverse p-th Roots of Large Sparse Matrices
M. Lass, S. Mohr, H. Wiebeler, T. Kühne, C. Plessl, in: Proc. Platform for Advanced Scientific Computing (PASC) Conference, ACM, New York, NY, USA, 2018.
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| DOI
| arXiv
M. Lass, S. Mohr, H. Wiebeler, T. Kühne, C. Plessl, in: Proc. Platform for Advanced Scientific Computing (PASC) Conference, ACM, New York, NY, USA, 2018.
2018 | Journal Article | LibreCat-ID: 37971
Trendbericht Organische Chemie 2017
B. Straub, J.N. Andexer, C. Arenz, U. Beifuss, F. Beuerle, M. Brasholz, R. Breinbauer, K. Ditrich, M. Ernst, T.A.M. Gulder, M. Kordes, A. Krueger, M. Lehmann, T. Lindel, S. Lüdeke, B. Luy, M.A.R. Meier, C. Mück-Lichtenfeld, C. Muhle-Goll, A. Narine, J. Paradies, R. Pfau, J. Pietruszka, N. Schaschke, M.O. Senge, T. Werner, D.B. Werz, C. Winter, D. Worgull, Nachrichten Aus Der Chemie 66 (2018) 249–280.
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B. Straub, J.N. Andexer, C. Arenz, U. Beifuss, F. Beuerle, M. Brasholz, R. Breinbauer, K. Ditrich, M. Ernst, T.A.M. Gulder, M. Kordes, A. Krueger, M. Lehmann, T. Lindel, S. Lüdeke, B. Luy, M.A.R. Meier, C. Mück-Lichtenfeld, C. Muhle-Goll, A. Narine, J. Paradies, R. Pfau, J. Pietruszka, N. Schaschke, M.O. Senge, T. Werner, D.B. Werz, C. Winter, D. Worgull, Nachrichten Aus Der Chemie 66 (2018) 249–280.
2018 | Journal Article | LibreCat-ID: 37968
1,8-Diazabicyclo[5.4.0]undec-7-ene-Catalyzed Carbonylative Cyclization of Propargylic Alcohols with Elemental Sulfur
Y. Hu, Z. Yin, T. Werner, A. Spannenberg, X.-F. Wu, European Journal of Organic Chemistry 2018 (2018) 1274–1276.
LibreCat
| DOI
Y. Hu, Z. Yin, T. Werner, A. Spannenberg, X.-F. Wu, European Journal of Organic Chemistry 2018 (2018) 1274–1276.
2018 | Journal Article | LibreCat-ID: 37967
Mechanistic Study on the Addition of CO2 to Epoxides Catalyzed by Ammonium and Phosphonium Salts: A Combined Spectroscopic and Kinetic Approach
J. Steinbauer, C. Kubis, R. Ludwig, T. Werner, ACS Sustainable Chemistry and Engineering 6 (2018) 10778–10788.
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| DOI
J. Steinbauer, C. Kubis, R. Ludwig, T. Werner, ACS Sustainable Chemistry and Engineering 6 (2018) 10778–10788.
2018 | Journal Article | LibreCat-ID: 37969
Copolymerization of CO2 and epoxides mediated by zinc organyls
C. Wulf, U. Doering, T. Werner, RSC Advances 8 (2018) 3673–3679.
LibreCat
| DOI
C. Wulf, U. Doering, T. Werner, RSC Advances 8 (2018) 3673–3679.
2018 | Journal Article | LibreCat-ID: 62105
Calcium-Based Catalytic System for the Synthesis of Bio-Derived Cyclic Carbonates under Mild Conditions
L. Longwitz, J. Steinbauer, A. Spannenberg, T. Werner, ACS Catalysis 8 (2018) 665–672.
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| DOI
L. Longwitz, J. Steinbauer, A. Spannenberg, T. Werner, ACS Catalysis 8 (2018) 665–672.
2018 | Journal Article | LibreCat-ID: 62802 | 
Metal-based nanostructured materials for advanced lithium–sulfur batteries
J. Balach, J. Linnemann, T. Jaumann, L. Giebeler, Journal of Materials Chemistry A 6 (2018) 23127–23168.
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| DOI
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J. Balach, J. Linnemann, T. Jaumann, L. Giebeler, Journal of Materials Chemistry A 6 (2018) 23127–23168.
2018 | Journal Article | LibreCat-ID: 62809 |
Electrodeposited metal-organic framework films as self-assembled hierarchically superstructured supports for stable omniphobic surface coatings
J. Sablowski, J. Linnemann, S. Hempel, V. Hoffmann, S. Unz, M. Beckmann, L. Giebeler, Scientific Reports 8 (2018).
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| DOI
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J. Sablowski, J. Linnemann, S. Hempel, V. Hoffmann, S. Unz, M. Beckmann, L. Giebeler, Scientific Reports 8 (2018).
2018 | Journal Article | LibreCat-ID: 23773
Context characteristics and their effects on students’ situational interest in chemistry
S. Habig, J. Blankenburg, H. van Vorst, S. Fechner, I. Parchmann, E. Sumfleth, International Journal of Science Education 40 (2018) 1154–1175.
LibreCat
| DOI
S. Habig, J. Blankenburg, H. van Vorst, S. Fechner, I. Parchmann, E. Sumfleth, International Journal of Science Education 40 (2018) 1154–1175.
2018 | Journal Article | LibreCat-ID: 13407
Structural dynamics upon photoexcitation-induced charge transfer in a dicopper(i)–disulfide complex
M. Naumova, D. Khakhulin, M. Rebarz, M. Rohrmüller, B. Dicke, M. Biednov, A. Britz, S. Espinoza, B. Grimm-Lebsanft, M. Kloz, N. Kretzschmar, A. Neuba, J. Ortmeyer, R. Schoch, J. Andreasson, M. Bauer, C. Bressler, W.G. Schmidt, G. Henkel, M. Rübhausen, Physical Chemistry Chemical Physics (2018) 6274–6286.
LibreCat
| DOI
M. Naumova, D. Khakhulin, M. Rebarz, M. Rohrmüller, B. Dicke, M. Biednov, A. Britz, S. Espinoza, B. Grimm-Lebsanft, M. Kloz, N. Kretzschmar, A. Neuba, J. Ortmeyer, R. Schoch, J. Andreasson, M. Bauer, C. Bressler, W.G. Schmidt, G. Henkel, M. Rübhausen, Physical Chemistry Chemical Physics (2018) 6274–6286.
2018 | Book Chapter | LibreCat-ID: 23774
Generation of students' questions through real-life contexts and their potential use for sustainability issues in chemistry education
L. Schmitz, S. Fechner, in: I. Eilks, S. Markic, B. Ralle (Eds.), Building Bridges across Disciplines for Transformative Eduction and a Sustainable Future, Shaker Verlag, Aachen, 2018, pp. 321–326.
LibreCat
L. Schmitz, S. Fechner, in: I. Eilks, S. Markic, B. Ralle (Eds.), Building Bridges across Disciplines for Transformative Eduction and a Sustainable Future, Shaker Verlag, Aachen, 2018, pp. 321–326.
2018 | Journal Article | LibreCat-ID: 23749
Unterscheidung von Kontexten für den Chemieunterricht
H. van Vorst, S. Fechner, E. Sumfleth, Zeitschrift für Didaktik der Naturwissenschaften 24 (2018) 167–181.
LibreCat
| DOI
H. van Vorst, S. Fechner, E. Sumfleth, Zeitschrift für Didaktik der Naturwissenschaften 24 (2018) 167–181.
2018 | Journal Article | LibreCat-ID: 58588
Low friction poly(amide-imide) coatings with silicones as tethered liquids
J. Ressel, O. Seewald, W. Bremser, H.-P. Reicher, O.I. Strube, Progress in Organic Coatings 124 (2018) 1–7.
LibreCat
| DOI
J. Ressel, O. Seewald, W. Bremser, H.-P. Reicher, O.I. Strube, Progress in Organic Coatings 124 (2018) 1–7.