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4279 Publications
2021 | Journal Article | LibreCat-ID: 22960 |
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Lattice parameters and electronic band gap of orthorhombic potassium sodium niobate K0.5Na0.5NbO3 from density-functional theory
N. Bidaraguppe Ramesh, F. Schmidt, A. Schindlmayr, The European Physical Journal B 94 (2021).
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N. Bidaraguppe Ramesh, F. Schmidt, A. Schindlmayr, The European Physical Journal B 94 (2021).
2021 | Journal Article | LibreCat-ID: 39653
Unraveling the electrochemical and spectroscopic properties of neutral and negatively charged perylene tetraethylesters
C. Wiebeler, J. Vollbrecht, A. Neuba, H.-S. Kitzerow, S. Schumacher, Scientific Reports 11 (2021).
LibreCat
| DOI
C. Wiebeler, J. Vollbrecht, A. Neuba, H.-S. Kitzerow, S. Schumacher, Scientific Reports 11 (2021).
2021 | Journal Article | LibreCat-ID: 24975
Controlled growth of ordered monolayers of N-heterocyclic carbenes on silicon
M. Franz, S. Chandola, M. Koy, R. Zielinski, H. Aldahhak, M. Das, M. Freitag, U. Gerstmann, D. Liebig, A.K. Hoffmann, M. Rosin, W.G. Schmidt, C. Hogan, F. Glorius, N. Esser, M. Dähne, Nature Chemistry (2021) 828–835.
LibreCat
| DOI
M. Franz, S. Chandola, M. Koy, R. Zielinski, H. Aldahhak, M. Das, M. Freitag, U. Gerstmann, D. Liebig, A.K. Hoffmann, M. Rosin, W.G. Schmidt, C. Hogan, F. Glorius, N. Esser, M. Dähne, Nature Chemistry (2021) 828–835.
2021 | Journal Article | LibreCat-ID: 23418 |
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Polaronic enhancement of second-harmonic generation in lithium niobate
A.L. Kozub, A. Schindlmayr, U. Gerstmann, W.G. Schmidt, Physical Review B 104 (2021) 174110.
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A.L. Kozub, A. Schindlmayr, U. Gerstmann, W.G. Schmidt, Physical Review B 104 (2021) 174110.
2021 | Bachelorsthesis | LibreCat-ID: 44234
Combining Mobility, Heterogeneity, and Leasing Approaches for Online Resource Allocation
T.F. Berger, Combining Mobility, Heterogeneity, and Leasing Approaches for Online Resource Allocation, 2021.
LibreCat
T.F. Berger, Combining Mobility, Heterogeneity, and Leasing Approaches for Online Resource Allocation, 2021.
2021 | Bachelorsthesis | LibreCat-ID: 44233
Online k-Facility Reallocation using k-Server Algorithms
S. Pranger, Online K-Facility Reallocation Using k-Server Algorithms, 2021.
LibreCat
S. Pranger, Online K-Facility Reallocation Using k-Server Algorithms, 2021.
2021 | Conference Paper | LibreCat-ID: 23465 |
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Forming of metastable austenitic stainless steel tubes with axially graded martensite content by flow-forming
B. Arian, W. Homberg, M. Riepold, A. Trächtler, J. Rozo Vasquez, F. Walther, in: ULiège Library, Liège, 2021.
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B. Arian, W. Homberg, M. Riepold, A. Trächtler, J. Rozo Vasquez, F. Walther, in: ULiège Library, Liège, 2021.
2021 | Journal Article | LibreCat-ID: 24901
Ethical Considerations of Applying Robots in Kindergarten Settings: Towards an Approach from a Macroperspective
N.F. Tolksdorf, S. Siebert, I. Zorn, I. Horwath, K.J. Rohlfing, International Journal of Social Robotics (2021) 129–140.
LibreCat
| DOI
N.F. Tolksdorf, S. Siebert, I. Zorn, I. Horwath, K.J. Rohlfing, International Journal of Social Robotics (2021) 129–140.
2021 | Newspaper Article | LibreCat-ID: 44392
Sammler und Beobachter. Das Programm der diesjährigen Internationalen Kurzfilmtage Oberhausen, Dschungel (jungle World)
S. Ahrens, Kinema Kommunal, Nummer 2, Juni 2021 (2021).
LibreCat
S. Ahrens, Kinema Kommunal, Nummer 2, Juni 2021 (2021).
2021 | Conference Paper | LibreCat-ID: 24280
Systematische Bewertung von Auswirkungsanalysen des Engineering Change Managements
I. Gräßler, D. Wiechel, in: D. Krause, K. Paetzold, S. Wartzack (Eds.), DS 111: Proceedings of the 32nd Symposium Design for X, 2021.
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I. Gräßler, D. Wiechel, in: D. Krause, K. Paetzold, S. Wartzack (Eds.), DS 111: Proceedings of the 32nd Symposium Design for X, 2021.
2021 | Journal Article | LibreCat-ID: 44896
A Comparative Analysis of Consumption: Evidence from a Cultural Goods Market
D. Kaimann, J. Cox, Sustainability 13 (2021).
LibreCat
| DOI
D. Kaimann, J. Cox, Sustainability 13 (2021).
2021 | Journal Article | LibreCat-ID: 21289
“I will survive”: Online streaming and the chart survival of music tracks
D. Kaimann, I. Tanneberg, J. Cox, Managerial and Decision Economics 42 (2021) 3–20.
LibreCat
| DOI
D. Kaimann, I. Tanneberg, J. Cox, Managerial and Decision Economics 42 (2021) 3–20.
2021 | Journal Article | LibreCat-ID: 44899
The Legacy of Gurus: The Impact of Armin Diel and Joel Payne on Winery Ratings in Germany
B. Frick, Journal of Wine Economics 15 (2021) 370–377.
LibreCat
| DOI
B. Frick, Journal of Wine Economics 15 (2021) 370–377.
2021 | Journal Article | LibreCat-ID: 45001
A Force Field for Bio-Polymers in Ionic Liquids (BILFF) – Part 1: [EMIm][OAc] / Water Mixtures
E. Roos, M. Brehm, Phys. Chem. Chem. Phys. 23 (2021) 1242–1253.
LibreCat
| DOI
E. Roos, M. Brehm, Phys. Chem. Chem. Phys. 23 (2021) 1242–1253.
2021 | Journal Article | LibreCat-ID: 45004
Optimized Atomic Partial Charges and Radii Defined by Radical Voronoi Tessellation of Bulk Phase Simulations
M. Brehm, M. Thomas, Molecules 26 (7) (2021) 1875.
LibreCat
| DOI
M. Brehm, M. Thomas, Molecules 26 (7) (2021) 1875.
2021 | Journal Article | LibreCat-ID: 45005
Unraveling Local Structure of Molten Salts via X-Ray Scattering, Raman Spectroscopy, and ab initio Molecular Dynamics
S. Roy, M. Brehm, S. Sharma, F. Wu, D. Maltsev, P. Halstenberg, L. Gallington, S. Mahurin, S. Dai, A. Ivanov, C. Margulis, V. Bryantsev, J. Phys. Chem. B 125 (22) (2021) 5971–5982.
LibreCat
| DOI
S. Roy, M. Brehm, S. Sharma, F. Wu, D. Maltsev, P. Halstenberg, L. Gallington, S. Mahurin, S. Dai, A. Ivanov, C. Margulis, V. Bryantsev, J. Phys. Chem. B 125 (22) (2021) 5971–5982.
2021 | Journal Article | LibreCat-ID: 45006
Liquid Structure and Dynamics in the Choline Acetate:Urea 1:2 Deep Eutectic Solvent
A. Triolo, M.E.D. Pietro, A. Mele, F.L. Celso, M. Brehm, V.D. Lisio, A. Martinelli, P. Chater, O. Russina, J. Chem. Phys. 154 (2021) 244501.
LibreCat
| DOI
A. Triolo, M.E.D. Pietro, A. Mele, F.L. Celso, M. Brehm, V.D. Lisio, A. Martinelli, P. Chater, O. Russina, J. Chem. Phys. 154 (2021) 244501.
2021 | Journal Article | LibreCat-ID: 45003
Switching Between Proton Vacancy and Excess Proton Transfer Pathways in the Reaction Between 7-Hydroxyquinoline and Formate
M.-A. Codescu, M. Weiß, M. Brehm, O. Kornilov, D. Sebastiani, E.T.J. Nibbering, J. Phys. Chem. A 125 (9) (2021) 1845–1859.
LibreCat
| DOI
M.-A. Codescu, M. Weiß, M. Brehm, O. Kornilov, D. Sebastiani, E.T.J. Nibbering, J. Phys. Chem. A 125 (9) (2021) 1845–1859.
2021 | Journal Article | LibreCat-ID: 45000
Efficient EOM-CC-Based Protocol for the Calculation of Electron Affinity of Solvated Nucleobases: Uracil as a Case Study
M. Mukherjee, D. Tripathi, M. Brehm, C. Riplinger, A.K. Dutta, J. Chem. Theory Comput. 17 (1) (2021) 105–116.
LibreCat
| DOI
M. Mukherjee, D. Tripathi, M. Brehm, C. Riplinger, A.K. Dutta, J. Chem. Theory Comput. 17 (1) (2021) 105–116.
2021 | Journal Article | LibreCat-ID: 45002
Liquid Structure of a Choline Chloride-Water Natural Deep Eutectic Solvent: A Molecular Dynamics Characterization
A. Triolo, F.L. Celso, M. Brehm, V.D. Lisio, O. Russina, J. Mol. Liq. 331 (2021) 115750.
LibreCat
| DOI
A. Triolo, F.L. Celso, M. Brehm, V.D. Lisio, O. Russina, J. Mol. Liq. 331 (2021) 115750.