High Performance Computing

PALMA II

PALMA II ("Paralleles Linux-System für Münsteraner Anwender") ist ein Computercluster mit über 18.000 Prozessorkernen, deren Zusammenwirken die Lösung hochkomplexer Aufgaben aus Wissenschaft und Forschung ermöglicht. Im Testbetrieb konnte im Linpack Benchmark eine Gesamtleistung von 800 TFlops ermittelt werden, womit PALMA II 2018 unter die Top500 der leistungsfähigsten Computersysteme weltweit fiel.

Technische Daten:
- über 18.000 Prozessorkerne
- Rechenleistung von über 800 TFlops
- 80 TB Hauptspeicher
- 800 TB Festplattenspeicher
Publikationen
2025
2024
2023
2022
2021
2020
2019
2018
2017
2016
2015
2014
2013
2012
2011
2010
2009
2008
2007
2006
2005
2004
2025
Schiller, Katharina, Janshoff, Saskia, Zenker, Sanja, Viehöver, Prisca, Hartwell, James, Eirich, Jürgen, Finkemeier, Iris, und Bräutigam, Andrea. 2025. „Regulation of Crassulacean acid metabolism at the protein level in Kalanchoë laxiflora.“ Plant Physiology 197 (4). doi: 10.1093/plphys/kiaf095.
Eirich, Jürgen, Née, Guillaume, Krüger, Thorben, Gasper, Michael, Drotleff, Julia, Romera-Branchat, Maida, Gehring, Elena, Brandt, Dennis, Bell, Christopher, Kramer, Katharina, Soppe, Wim, Sodenkamp, Johanna, Finkemeier, Iris, und Ahloumessou, Florian. 2025. „DOG1 controls dormancy independently from ABA core signaling kinases regulation by preventing AFP dephosphorylation through AHG1.“ Science advances 11 (9). doi: 10.1126/sciadv.adr8502.
Seidel, Julian, Schönfeld, Caroline, Sindlinger, Julia, Eirich, Jürgen, Kirchgäßner, Sören, Kreienkamp, Nina, Schulze‐Osthoff, Klaus, Finkemeier, Iris, Hailfinger, Stephan, und Schwarzer, Dirk. 2025. „Interactome Profiling of a Lysine Deacetylase Trapping Probe Library Uncovers Crosstalk Between HDAC6 and NF‐κB Signaling.“ Angewandte Chemie International Edition 2025 (e202510967). doi: 10.1002/anie.202510967.
Kartmann, Michael, Klein, Benedikt, Ohlberger, Mario, Schuster, Thomas, und Volkwein, Stefan. 2025. „Adaptive Reduced Basis Trust Region Methods for Parabolic Inverse Problems.“ Preprint. arXiv doi: 10.48550/arXiv.2507.11130.
Brandt, Benjamin, Schwartz, Sebastian, Schwenkert, Serena, Krämer, Moritz, Om, Kuenzang, Engstler, Carina, Klingl, Andreas, Jahns, Peter, Eirich, Jürgen, Finkemeier, Iris, Cousins, Benjamin Asaph, und Kunz, Hans-Henning. 2025. „Plant cells tolerate high rates of organellar mistranslation.“ Preprint. biorxiv.org doi: 10.1101/2025.03.07.642005.
Pielage, Leon, Schmidle, Paul, Marschall, Bernhard, und Risse, Benjamin. 2025. „Interactive High-Quality Skin Lesion Generation using Diffusion Models for VR-based Dermatological Education.“ In IUI '25: Proceedings of the 30th International Conference on Intelligent User Interfaces, herausgegeben von Association for Computing Machinery. New York, NY, United States: ACM Press. doi: 10.1145/3708359.3712101.
Wolff, Matthias, Eilers, Florian, und Jiang, Xiaoyi. im Druck. „CVKAN: Complex-valued Kolmogorov-Arnold Networks.“ Preprint. In Proc. of IJCNN doi: 10.48550/arXiv.2502.02417.
Guljanov, Gaygysyz, und Mutschler, Willi. 2025. Data for: Chapter 2 of "Estimation of DSGE models: Skewness matters" : Comparison of optimizers and samplers in Dynare doi: 10.17879/44918563945.
Blossier, B., Neuendorf, J., Heitger, J., und San José, T. 2025. „The hadronic decay of vector charmonium.“ Beitrag präsentiert auf der 41th International Symposium on Lattice Field Theory (Lattice 2024), Liverpool doi: 10.22323/1.466.0428.
Krämer, Alina, Meyer, Hanna, und Buchholz, Sascha. 2025. „Habitat Suitability of the Sand Lizard (Lacerta agilis) at Its Distribution Limit—An Analysis Based on Citizen Science Data and Machine Learning.“ Journal of Biogeography 52 e15099. doi: 10.1111/jbi.15099.
Klein, Benedikt, und Ohlberger, Mario. 2025. „A Trust Region RB-ML-ROM Approach for Parabolic PDE Constrained Optimization.“ Preprint. In MATHMOD 2025 - Discussion Contribution Volume, herausgegeben von Andreas Körner, Andreas Kugi, Wolfgang Kemmetmüller, Andreas Deutschmann-Olek, Andreas Steinböck, Christian Hartl-Nesic und Lukasz Piotr Jadachowski. Wien: ARGESIM Verlag. doi: 10.34726/9000.
Baur, Moritz, Schulz, Nora KE, Greune, Lilo, Länger, Zoe M, Eirich, Jürgen, Finkemeier, Iris, Peuss, Robert, Dersch, Petra, und Kurtz, Joachim. 2025. „Immune priming in the insect gut: a dynamic response revealed by ultrastructural and transcriptomic changes.“ Preprint. BMC Biology 23. doi: 10.1186/s12915-025-02334-4.
Ruaud, S, Nötzold, SI, Waller, M, Galbier, F, Mousavi, SS, Charran, M, Zeeman, S, Bailly, A, Baroux, C, Hippler, M, Wicke, S, und Szövényi, P. 2025. „Molecular underpinnings of hornwort carbon concentrating mechanisms: subcellular localization of putative key molecular components in the model hornwort Anthoceros agrestis.“ New Phytologist Early View. doi: 10.1101/2024.06.24.596764.
Hellmann, Margareta J., Marongiu, Gian Luca, Gorzelanny, Christian, Moerschbacher, Bruno M., und Cord-Landwehr, Stefan. 2025. „Hydrolysis of chitin and chitosans by the human chitinolytic enzymes: chitotriosidase, acidic mammalian chitinase, and lysozyme.“ International Journal of Biological Macromolecules 297 (139789). doi: 10.1016/j.ijbiomac.2025.139789.
2024
Schiller, Katharina, Janshoff, Saskia, Zenker, Sanja, Viehöver, Prisca, Hartwell, James, Eirich, Jürgen, Finkemeier, Iris, und Bräutigam, Andrea. 2024. „Regulation of Crassulacean Acid Metabolism at the protein level in the CAM plant Kalanchoë laxiflora.“ Preprint. biorxiv.org doi: 10.1101/2024.10.25.620298.
Wolters, SM, Laibach, N, Riekötter, J, Roelfs, KU, Müller, B, Eirich, J, Twyman, RM, Finkemeier, I, Prüfer, D, und Schulze, Gronover C. 2024. „The interaction networks of small rubber particle proteins in the latex of <i>Taraxacum koksaghyz</i> reveal diverse functions in stress responses and secondary metabolism.“ Frontiers in Plant Science 15: 1498737–1498737. doi: 10.3389/fpls.2024.1498737.
Becker, Marlon, Butz, Marco, Lemli, David, Schuck, Carsten, und Risse, Benjamin. 2024. „Learning Proposal Distributions in Simulated Annealing via Template Networks: A Case Study in Nanophotonic Inverse Design.“ In Pattern Recognition, Bd. 27 aus 27th International Conference ICPR 2024, herausgegeben von Apostolos Antonacopoulos, Subhasis Chaudhuri, Rama Chellappa, Cheng-Lin Liu, Saumik Bhattacharya und Umapada Pal. Kolkata, India: Springer. doi: 10.1007/978-3-031-78186-5_13.
Bender, Alexander Boydere, Füsun Jayavelu, Ashok Kumar Tibello, Alessia König, Thorsten Aleth, Hanna Meyer zu Hörste, Gerd Vogl, und Thomas Rosenbauer, Frank. 2024. „Redistribution of PU.1 partner transcription factor RUNX1 binding secures cell survival during leukemogenesis.“ The EMBO Journal 43: 6291–6309. doi: 10.1038/s44318-024-00295-y.
Böger, Thorben, Bernges, Tim, Agne, Matthias T., Canepa, Pieremanuele, Tietz, Frank, und Zeier, Wolfgang G. 2024. „On the Thermal Conductivity and Local Lattice Dynamical Properties of NASICON Solid Electrolytes.“ Journal of the American Chemical Society 146 (47): 32678–32688. doi: 10.1021/jacs.4c12034.
Guljanov, Gaygysyz. 2024. „Estimation of DSGE models: Skewness matters.“ Dissertationsschrift, Universität Münster. doi: 10.17879/35918450119.
Engwer, Christian, Ohlberger, Mario, und Renelt, Lukas. 2024. „Model order reduction of an ultraweak and optimally stable variational formulation for parametrized reactive transport problems.“ Preprint. SIAM Journal on Scientific Computing 46 (5): A3205–A3229. doi: 10.1137/23M1613402.
Klink, BU, Alavizargar, A, Kalyankumar, KS, Chen, M, Heuer, A, und Gatsogiannis, C. 2024. „Structural basis of α-latrotoxin transition to a cation-selective pore.“ Nature Communications 15 (1): 8551–8551. doi: 10.1038/s41467-024-52635-5.
Schulte, L, Butz, M, Becker, M, Risse, B, und Schuck, C. 2024. „Accelerating Finite-Difference Frequency-Domain Simulations for Inverse Design Problems in Nanophotonics using Deep Learning.“ Journal of the Optical Society of America B 41 (4): 1039–1046. doi: 10.1364/JOSAB.506159.
Helm, Bianca, Strotmann, Kyra, Böger, Thorben, Banik, Ananya, Lange, Martin Alexander, Li, Yuheng, Li, Cheng, Canepa, Pieremanuele, und Zeier, Wolfgang G. 2024. „Reducing the Defect Formation Energy by Aliovalent Sn(+IV) and Isovalent P(+V) Substitution in Li3SbS4 Promotes Li+ Transport.“ ACS Applied Energy Materials 7 (5): 1735–1747. doi: 10.1021/acsaem.3c02652.
Busch, AS, Ljubicic, ML, Upners, EN, Fischer, MB, Odroniec, A, Hagen, CP, und Juul, A. 2024. „Polygenic Scores for Adult Testosterone and SHBG Levels Are Associated With Reproductive Hormone Levels in Male Infants.“ Journal of Clinical Endocrinology and Metabolism 109 (5): 1–6. doi: 10.1210/clinem/dgae104.
Keil, Tim, und Ohlberger, Mario. 2024. „A Relaxed Localized Trust-Region Reduced Basis Approach for Optimization of Multiscale Problems.“ Preprint. ESAIM: Mathematical Modelling and Numerical Analysis 58: 79–105. doi: 10.1051/m2an/2023089.
Kockwelp, Jacqueline, Thiele, Sebastian, Bartsch, Jannis, Haalck, Lars, Gromoll, Jörg, Schlatt, Stefan, Exeler, Rita, Bleckmann, Annalen, Lenz, Georg, Wolf, Sebastian, Steffen, Björn, Berdel, Wolfgang Eduard, Schliemann, Christoph, Risse, Benjamin, und Angenendt, Linus. 2024. „Deep learning predicts therapy-relevant genetics in acute myeloid leukemia from Pappenheim-stained bone marrow smears.“ Blood Advances 8 (1): 70–79. doi: 10.1182/bloodadvances.2023011076.
Chaturvedi, M, Köster, D, Rübsamen, N, Jaeger, VK, Zapf, A, und Karch, A. 2024. „The impact of inaccurate assumptions about antibody test accuracy on the parametrisation and results of infectious disease models of epidemics.“ Epidemics 46: 100741–100741. doi: 10.1016/j.epidem.2024.100741.
Beckmann, Daniel, Kockwelp, Jacqueline, Gromoll, Joerg, Kiefer, Friedemann, und Risse, Benjamin. 2024. „SAM meets Gaze: Passive Eye Tracking for Prompt-based Instance Segmentation.“ Proceedings of Machine Learning Research 2023.
Gebauer, Eike, Thiele, Sebastian, Ouvrard, Pierre, Sicard, Adrien, und Risse, Benjamin. 2024. „Towards a Dynamic Vision Sensor-based Insect Camera Trap.“ Beitrag präsentiert auf der Winter Conference on Applications of Computer Vision 2024, Waikoloa, Hawaii
Hosseini, Henry, Utz, Christine, Degeling, Martin, und Hupperich, Thomas. 2024. „A Bilingual Longitudinal Analysis of Privacy Policies Measuring the Impacts of the GDPR and the CCPA/CPRA.“ Proceedings on Privacy Enhancing Technologies 2024 (2): 434–463. doi: 10.56553/popets-2024-0058.
Wolff, R, Hölzer, K, Hetzel, R, Dunkl, I, und Anczkiewicz, AA. 2024. „Late-orogenic extension ceases with waning plate convergence: The case of the Simplon normal fault (Swiss Alps).“ Journal of Structural Geology 179: 1–13. doi: 10.1016/j.jsg.2024.105049.
Bröker, Stephan, te Vrugt, Michael, Jeggle, Julian, Stenhammar, Joakim, und Wittkowski, Raphael. 2024. „Pair-distribution function of active Brownian spheres in three spatial dimensions: Simulation results and analytical representation.“ Soft Matter 20: 224–244. doi: 10.1039/D3SM00987D.
Fritzsch, Patrick, Heitger, Jochen, Joswig, Fabian, und Kuhlmann, Justus T. 2024. „Towards charm physics with stabilised Wilson fermions.“ Preprint. Beitrag präsentiert auf der 40th International Symposium on Lattice Field Theory (Lattice 2023), Fermilab, USA doi: 10.48550/arXiv.2401.05885.
Neuendorf, Jan, Heitger, Jochen, Egbring, Giulia, Höllwieser, Roman, Knechtli, Francesco, Korzec, Tomasz, und Urrea-Nino, Juan Andres. 2024. „Optimized Distillation Profiles for Heavy-Light Spectroscopy.“ Beitrag präsentiert auf der 40th International Symposium on Lattice Field Theory (Lattice 2023), Fermilab, USA doi: 10.22323/1.453.0057.
Conigli, Alessandro, Frison, Julien, Fritzsch, Patrick, Gerardin, Antoine, Heitger, Jochen, Herdoiza, Gregorio, Kuberski, Simon, Pena, Carlos, Simma, Hubert, und Sommer, Rainer. 2024. „A strategy for B-physics observables in the continuum limit.“ Preprint. Beitrag präsentiert auf der 40th International Symposium on Lattice Field Theory (Lattice 2023), Fermilab, USA doi: 10.48550/arXiv.2312.09811.
Conigli, Alessandro, Frison, Julien, Fritzsch, Patrick, Gerardin, Antoine, Heitger, Jochen, Herdoiza, Gregorio, Kuberski, Simon, Pena, Carlos, Simma, Hubert, und Sommer, Rainer. 2024. „m_b and f_B^(*) in 2 + 1 flavour QCD from a combination of continuum limit static and relativistic results.“ Preprint. Beitrag präsentiert auf der 40th International Symposium on Lattice Field Theory (Lattice 2023), Fermilab, USA doi: 10.48550/arXiv.2312.10017.
Singh, A, Thale, S, Leibner, T, Lamparter, L, Ricker, A, Nüsse, H, Klingauf, J, Galic, M, Ohlberger, M, und Matis, M. 2024. „Dynamic interplay of microtubule and actomyosin forces drive tissue extension.“ Nature Communications 15 (1): 3198–3198. doi: 10.1038/s41467-024-47596-8.
Tim, Keil, Mario, Ohlberger, Felix, Schindler, und Julia, Schleuß. 2024. „Local training and enrichment based on a residual localization strategy.“ Preprint. In Proceedings of the Conference Algoritmy 2024, Bd. 8 aus Proceedings of the Conference Algoritmy, herausgegeben von P Frolkovič, K Mikula und D Ševčovič. Bratislava: Jednota slovenských matematikov a fyzikov.
Pauls, Jan, Zimmer, Max, Kelly, Una M., Schwartz, Martin, Saatchi, Sassan, Ciais, Philippe, Pokutta, Sebastian, Brandt, Martin, und Gieseke, Fabian. im Druck. „Estimating Canopy Height at Scale.“ In Proceedings of the 41st International Conference on Machine Learning (ICML)
Eirich, Jürgen, Boyer, Jean-Baptiste, Armbruster, Laura, Ivanauskaite, Aiste, Torre La De, Carolina, Meinnel, Thierry, Wirtz, Markus, Mulo, Paula, Finkemeier, Iris, und Giglione, Carmela. 2024. „Light Changes Promote Distinct Responses of Plastid Protein Acetylation Marks.“ Molecular and Cellular Proteomics 23 (11) 100845. doi: 10.1016/j.mcpro.2024.100845.
Brünje, Annika, Füßl, Magdalena, Eirich, Jürgen, Boyer, Jean-Baptiste, Heinkow, Paulina, Neumann, Ulla, Konert, Minna, Ivanauskaite, Aiste, Seidel, Julian, Ozawa, Shin-Ichiro, Sakamoto, Wataru, Meinnel, Thierry, Schwarzer, Dirk, Mulo, Paula, Giglione, Carmela, und Finkemeier, Iris. 2024. „The plastidial protein acetyltransferase GNAT1 forms a complex with GNAT2, yet their interaction is dispensable for state transitions.“ Molecular and Cellular Proteomics 23 (11) 100850. doi: 10.1016/j.mcpro.2024.100850.
Koller, H., und Hunger, M. 2024. „Response of Hydrogen-Bonded Brnsted Acid Sites in ZSM-5 to Adsorption and H\/D Exchange of Hydrocarbons.“ Journal of Physical Chemistry C 128 (22): 8974–8982. doi: 10.1021/acs.jpcc.4c01199.
Park, Y., Koller, H., Lew, C.M., Zones, S.I., und Davis, M.E. 2024. „Correlating Local Geometry to 11B NMR Chemical Shift of Tetrahedrally Coordinated Boron in Molecular Sieves.“ Journal of Physical Chemistry C 128 (25): 10705–10713. doi: 10.1021/acs.jpcc.4c02361.
Kuberski, S., Joswig, F., Collins, S., Heitger, J., und Söldner, W. 2024. „D and D_s decay constants in N_f = 2 + 1 QCD with Wilson fermions.“ Journal of High Energy Physics (JHEP) 07 90. doi: 10.1007/JHEP07(2024)090.
Bröker, Stephan, te Vrugt, Michael, und Wittkowski, Raphael. 2024. „Collective dynamics and pair-distribution function of active Brownian ellipsoids in two spatial dimensions.“ Communications Physics 7 (1) 238. doi: 10.1038/s42005-024-01674-x.
Bröker, Stephan, te Vrugt, Michael, Jeggle, Julian, Stenhammar, Joakim, und Wittkowski, Raphael. 2024. „Pair-distribution function of active Brownian spheres in three spatial dimensions: simulation results and analytical representation.“ Soft Matter 20 (1): 224–244. doi: 10.1039/D3SM00987D.
Chimirri, L., Fritzsch, P., Heitger, J., Joswig, F., Panero, M., Pena, C., und Preti, D. 2024. „Non-perturbative renormalisation and improvement of non-singlet tensor currents in N_f = 3 QCD.“ Journal of High Energy Physics (JHEP) 07 089. doi: 10.1007/JHEP07(2024)089.
A., Conigli, Frison, J., Fritzsch, P., Gérardin, A., Heitger, J., Herdoiza, G., Kuberski, S., Pena, C., Simma, H., und Sommer, R. 2024. „B-physics observables in the continuum from a combination of static and relativistic results.“ Beitrag präsentiert auf der EuroPLEx Final Conference, Berlin doi: 10.22323/1.451.0005.
Mitton-Fry, Rachel M., Eschenbach, Jannik, Schepers, Helena, Rasche, René, Erguven, Mehmet, Kümmel, Daniel, Rentmeister, Andrea, und Cornelissen, Nicolas V. 2024. „Chemo-enzymatic production of base-modified ATP analogues for polyadenylation of RNA.“ Chemical science 15 (32): 13068–13073. doi: 10.1039/d4sc03769c.
Hellmann, Margareta J. 2024. „Influence of cell wall modifications by chitin deacetylases in Cryptococcus neoformans on the human immune response.“ Dissertationsschrift, Universität Münster. doi: 10.17879/35918626257.
Wenzel, Tizian, Haasdonk, Bernard, Kleikamp, Hendrik, Ohlberger, Mario, und Schindler, Felix. 2024. „Application of Deep Kernel Models for Certified and Adaptive RB-ML-ROM Surrogate Modeling.“ Preprint. In Large-Scale Scientific Computations, Bd. 13952 aus Lecture Notes in Computer Science, herausgegeben von I. Lirkov und S. Margenov. Cham: Springer Nature. doi: 10.1007/978-3-031-56208-2_11.
Hölzer, K, Wolff, R, Hetzel, R, und Dunkl, I. 2024. „The long-lasting exhumation history of the Ötztal-Stubai Complex (Eastern European Alps): New constraints from zircon (U-Th)/He age-elevation profiles and thermo-kinematic modeling.“ Lithosphere 2024: 1–20. doi: 10.2113/2024/lithosphere_2023_174.
2023
Hartmann, Philipp, Bohdan, Kostiantyn, Hommrich, Moritz, Juliá, Fabio, Vogelsang, Lara, Eirich, Jürgen, Zangl, Rene, Farès, Christophe, Jacobs, Beatrice Julia, Mukhopadhyay, Dwaipayan, Mengeler, Marie Johanna, Vetere, Alessandro, Sterling, Sophie Marie, Hinrichs, Heike, Becker, Stefan, Morgner, Nina, Schrader, Wolfgang, Finkemeier, Iris, Dietz, Karl-Josef, Griesinger, Christian, und Ritter, Tobias. 2023. „Chemoselective umpolung of thiols to episulfoniums for cysteine bioconjugation.“ Nature Chemistry 2023. doi: 10.1038/s41557-023-01388-7.
Timmerkamp, M, Lüpken, NM, Abazi, SA, Bankwitz, JR, Schuck, C, und Fallnich, C. 2023. „Toward integrated tantalum pentoxide optical parametric oscillators.“ Preprint. Optics Letters 48 (17): 4621–4624. doi: 10.1364/OL.496990.
Fiaschi, Juri, Fuks, Benjamin, Klasen, Michael, und Neuwirth, Alexander Puck. 2023. „Electroweak superpartner production at 13.6 Tev with Resummino.“ The European Physical Journal C 83. doi: 10.1140/epjc/s10052-023-11888-y.
Ali, S, Bergner, G, López, C, Montvay, I, Münster, G, und Piemonte, S. 2023. „Baryonic states in N=1 supersymmetric SU(2) Yang-Mills theory on the lattice.“ The European Physical Journal C 83 558. doi: 10.1140/epjc/s10052-023-11730-5.
De, Vleeschouwer David, Penman, DE, D'haenens, S, Wu, F, Westerhold, T, Vahlenkamp, M, Cappelli, C, Agnini, C, Kordesch, WEC, King, DJ, van, der Ploeg R, Pälike, H, Turner, SK, Wilson, P, Norris, RD, Zachos, JC, Bohaty, SM, und Hull, PM. 2023. „North Atlantic Drift Sediments Constrain Eocene Tidal Dissipation and the Evolution of the Earth‐Moon System.“ Paleoceanography and Paleoclimatology 38 (2) e2022PA004555. doi: 10.1029/2022pa004555.
Kleine, Bardenhorst S, Cereda, E, Severgnini, M, Barichella, M, Pezzoli, G, Keshavarzian, A, Desideri, A, Pietrucci, D, Aho, VTE, Scheperjans, F, Hildebrand, F, Weis, S, Egert, M, Karch, A, Vital, M, und Rübsamen, N. 2023. „Gut microbiota dysbiosis in Parkinson's disease - a systematic review and pooled analysis.“ European Journal of Neurology 30. doi: 10.1111/ene.15671.
Becker, Marlon, Drees, Dominik, Brückerhoff-Plückelmann, Frank, Schuck, Carsten, Pernice, Wolfram, und Risse, Benjamin. 2023. „Activation Functions in Non-Negative Neural Networks.“ präsentiert auf der Machine Learning and the Physical Sciences Workshop, NeurIPS, New Orleans.
Hagedorn, Thomas, Kösters, Till, Specht, Sebastian, und Wessel, Jan. 2023. „No Need for Speed: Fuel Prices, Driving Speeds, and the Revealed Value of Time on the German Autobahn.“ Institute of Transport Economics Münster — Working Paper Nr. 39. Münster.
Böger, Thorben, Bernges, Tim, Li, Yuheng, Canepa, Pieremanuele, und Zeier, Wolfgang G. 2023. „Thermal Conductivities of Lithium-Ion-Conducting Solid Electrolytes.“ ACS Applied Energy Materials 6 (20): 10704–10712. doi: 10.1021/acsaem.3c01977.
Nielsen, EB, Katurji, M, Zawar-Reza, P, und Meyer, H. 2023. „Antarctic daily mesoscale air temperature dataset derived from MODIS land and ice surface temperature.“ Scientific data 10 (1): 833–833. doi: 10.1038/s41597-023-02720-z.
Bröker, Stephan, Bickmann, Jens, te Vrugt, Michael, Cates, Michael E., und Wittkowski, Raphael. 2023. „Orientation-dependent propulsion of active Brownian spheres: from self-advection to programmable cluster shapes.“ Physical Review Letters 131 (16) 168203. doi: 10.1103/PhysRevLett.131.168203.
Bickmann, Jens, Bröker, Stephan, te Vrugt, Michael, und Wittkowski, Raphael. 2023. „Active Brownian particles in external force fields: field-theoretical models, generalized barometric law, and programmable density patterns.“ Physical Review E 108 (4) 044601. doi: 10.1103/PhysRevE.108.044601.
Deng, Yong, Paskert, Adrian, Zhang, Zhiyuan, Wittkowski, Raphael, und Ahmed, Daniel. 2023. „An acoustically controlled helical microrobot.“ Science advances 9 (38) eadh526. doi: 10.1126/sciadv.adh5260.
Voß, Johannes, und Wittkowski, Raphael. 2023. „Dependence of the acoustic propulsion of nano- and microcones on their orientation and aspect ratio.“ Scientific Reports 13 12858. doi: 10.1038/s41598-023-39231-1.
Evers, Marina, und Wittkowski, Raphael. 2023. „An active colloidal system showing parallels to a time crystal.“ Physica Scripta 98 (12) 125240. doi: 10.1088/1402-4896/ad05ab.
Becker, Marlon, Riegelmeyer, Jan, Seyfried, Maximilian David, Ravoo, Bart Jan, Schuck, Carsten, und Risse, Benjamin. 2023. „Adaptive Photochemical Nonlinearities for Optical Neural Networks.“ Advanced Intelligent Systems 5 (12). doi: 10.1002/aisy.202300229.
Hoffknecht, Jan-Philipp, Wettstein, Alina, Atik, Jaschar, Krause, Christian, Thienenkamp, Johannes, Brunklaus, Gunther, Winter, Martin, Diddens, Diddo, Heuer, Andreas, und Paillard, Elie. 2023. „Coordinating Anions ‘to the Rescue’ of the Lithium Ion Mobility in Ternary Solid Polymer Electrolytes Plasticized With Ionic Liquids.“ Advanced Energy Materials 13 (1) 2202789. doi: 10.1002/aenm.202202789.
Keil, Tim, und Rave, Stephan. 2023. „An Online Efficient Two-Scale Reduced Basis Approach for the Localized Orthogonal Decomposition.“ SIAM Journal on Scientific Computing 45 (4). doi: 10.1137/21M1460016.
Landstorfer, M, Ohlberger, M, Rave, S, und Tacke, M. 2023. „A Modeling Framework for Efficient Reduced Order Simulations of Parametrized Lithium-Ion Battery Cells.“ European Journal of Applied Mathematics 34 (3): 554–591. doi: 10.1017/S0956792522000353.
Wolff, R, Hetzel, R, Hölzer, K, Dunkl, I, Xu, Qiang, Anczkiewicz, AA, und Li, Zhenyu. 2023. „Rift propagation in south Tibet controlled by underthrusting of India: A case study at the Tangra Yumco graben (south Tibet).“ Journal of the Geological Society 1: 1–14. doi: 10.1144/jgs2022-090.
Butz, Marco, Abazi, Adrian S., Ross, Rene, Risse, Benjamin, und Schuck, Carsten. 2023. „Inverse Design of Nanophotonic Devices using Dynamic Binarization.“ Optics Express 31 (10): 15747–15756. doi: 10.1364/OE.484484.
Ludwig, M, Moreno-Martinez, A, Hölzel, N, Pebesma, E, und Meyer, H. 2023. „Assessing and improving the transferability of current global spatial prediction models.“ Global Ecology and Biogeography 00: 1–13. doi: 10.1111/geb.13635.
Ohlberger, M., Banholzer, S., Haasdonk, B., Keil, T.Kleikamp H., Mechelli, L., Oguntola, M, Schindler F., Volkwein, S., und Wenzel, T. 2023. „Model Reduction and Learning for PDE Constrained Optimization.“ Beitrag präsentiert auf der Oberwolfach Workshop on Optimization Problems for PDEs in Weak Space-Time Form, Oberwolfach doi: 10.4171/OWR/2023/13.
Zhang, Jian; Hetzel, Ralf; Pan, Baotian; Geng, Haopeng; Wolff, Reinhard; Chen, Dianbao. 2023. „A 10Be-based paleo-erosion record for the Qilian Shan (NE Tibet) over the past 4.2 Ma from a drillcore in the Hexi Corridor.“ Geomorphology 430: 1–10. doi: 10.1016/j.geomorph.2023.108657.
Tilak, P., Kotnik, F., Née, G., Seidel, J., Sindlinger, J., Heinkow, P., Eirich, J., Schwarzer, D., und Finkemeier, I. 2023. „Proteome-wide lysine acetylation profiling to investigate the involvement of histone deacetylase HDA5 in the salt stress response of Arabidopsis leaves.“ The Plant journal 115 (1): 275–292. doi: 10.1111/tpj.16206.
Chen, Ya-Fan, Schroeder, Christian, Lew, Christopher M., Zones, Stacey I., Koller, Hubert, und Sierka, Marek. 2023. „Cooperativity of Silanol Defect Chemistry in Zeolites.“ Physical Chemistry Chemical Physics 25: 478–485. doi: 10.1039/D2CP05218K.
Schroeder, Christian, Hansen, Michael Ryan, und Koller, Hubert. 2023. „Spatial Proximities Between Brønsted Acid Sites, AlOH Groups and Residual NH4+ Cations in Zeolites Mordenite and Ferrierite.“ Journal of Physical Chemistry C 127: 736–745. doi: 10.1021/acs.jpcc.2c07346.
Koller, Hubert. 2023. „7.3 Zeolites for Ion Exchange, Adsorption and Catalysis.“ In Applied Inorganic Chemistry, Vol. 2: From Energy Storage to Photofunctional Materials , herausgegeben von R. Pöttgen, T. Jüstel und C. Strassert. Berlin, Boston: De Gruyter. doi: 10.1515/9783110798890-018.
Bismarck, von Thekla, Korkmaz, Kübra, Ruß, Jeremy, Skurk, Kira, Kaiser, Elias, Galvis, Correa Viviana, Cruz, A.Jeffrey, Strand, D.Deserah, Köhl, Karin, Eirich, Jürgen, Finkemeier, Iris, Jahns, Peter, Kramer, M.David, und Armbruster, Ute. 2023. „Light acclimation interacts with thylakoid ion transport to govern the dynamics of photosynthesis in Arabidopsis.“ New Phytologist 2022. doi: 10.1111/nph.18534.
Timmerkamp, Maximilian, und Fallnich, Carsten. 2023. „Efficient Intermodal Dispersive Wave Generation via Group Velocity Matching.“ Beitrag präsentiert auf der Advanced Photonics Congress 2023, Busan doi: 10.1364/IPRSN.2023.JTu4A.9.
Wölfler, Andreas, Wolff, Reinhard, Hampel, Andrea, Hetzel, Ralf, und Dunkl, István. 2023. „Phases of enhanced exhumation during the Cretaceous and Cenozoic orogenies in the Eastern European Alps: new insights from thermochronological data and thermokinematic modeling.“ Tectonics 42 e2022TC007698. doi: 10.1029/2022TC007698.
Butz, M, Leifhelm, A, Becker, M, Risse, B, und Schuck, C. 2023. „A Universal Approach to Nanophotonic Inverse Design through Reinforcement Learning.“ In CLEO 2023, paper STh4G.3, herausgegeben von Optica Publishing Group San Jose: Optica. doi: 10.1364/CLEO_SI.2023.STh4G.3.
Lemli, David, Butz, Marco, und Schuck, Carsten. 2023. „Fabrication of Computer-Generated Nanophotonic Devices.“ präsentiert auf der DPG Springmeeting 2023, Hannover.
Butz, Marco, Leifhelm, Alexander, Becker, Marlon, Risse, Benjamin, und Schuck, Carsten. 2023. „A Novel Approach to Nanophotonic Black-Box Optimization Through Reinforcement Learning.“ In Q 30 Nano-optics, herausgegeben von DPG Hannover: Deutsche Physikalische Gesellschaft.
Haalck, Lars, Thiele, Sebastian, und Risse, Benjamin. 2023. „Tracking Tiny Insects in Cluttered Natural Environments using Refinable Recurrent Neural Networks.“ Beitrag präsentiert auf der IEEE/CVF Winter Conference on Applications of Computer Vision (WACV), Waikoloa, Hawaii doi: 10.1109/WACV57701.2024.00697.
Czuppon, Peter, Day, Troy, Débarre, Florence, und Blanquart, François. 2023. „A stochastic analysis of the interplay between antibiotic dose, mode of action, and bacterial competition in the evolution of antibiotic resistance.“ PLoS Computational Biology 19. doi: 10.1371/journal.pcbi.1011364.
Länger, Marie Zoe, Baur, Moritz, Korša, Ana, Eirich, Jürgen, Lindeza, Sofia Ana, Zanchi, Caroline, Finkemeier, Iris, und Kurtz, Joachim. 2023. „Differential proteome profiling of bacterial culture supernatants reveals candidates for the induction of oral immune priming in the red flour beetle.“ Biology Letters 19 (11). doi: 10.1098/rsbl.2023.0322.
Rüttermann M.; Koci M.; Lill P.; Geladas E.D.; Kaschani F.; Klink B.U.; Erdmann R.; Gatsogiannis C.. 2023. „Structure of the peroxisomal Pex1/Pex6 ATPase complex bound to a substrate.“ Nature Communications 14 (1). doi: 10.1038/s41467-023-41640-9.
2022
Sinha, Neha, Eirich, Jürgen, Finkemeier, Iris, und Grimm, Bernhard. 2022. „Glutamate 1-semialdehyde aminotransferase is connected to GluTR by GluTR-binding protein and contributes to the rate-limiting step of 5-aminolevulinic acid synthesis.“ The Plant cell 34. doi: 10.1093/plcell/koac237.
Weyer, Rita, Hellmann, Margareta J., Hamer-Timmermann, Stefanie N., Singh, Ratna, und Moerschbacher, Bruno M. 2022. „Customized chitooligosaccharide production - controlling their length via engineering of rhizobial chitin synthases and the choice of expression system.“ Frontiers in Bioengineering and Biotechnology 10. doi: 10.3389/fbioe.2022.1073447.
Bergner, G, Münster, G, und Piemonte, S. 2022. „Exploring gauge theories with adjoint matter on the lattice.“ universe 8: 617. doi: 10.3390/universe8120617.
Fischer, Mirko, Heuer, Andreas, und Diddens, Diddo. 2022. „Structure and Transport Properties of Poly(ethylene oxide)-Based Cross-Linked Polymer Electrolytes─A Molecular Dynamics Simulations Study.“ Macromolecules 55 (22): 10229–10242. doi: 10.1021/acs.macromol.2c01795.
Timmerkamp, Maximilian, Lüpken, Niklas M., Abazi, Shiqiprim Adrian, Bankwitz, Julian Rasmus, Schuck, Carsten, und Fallnich, Carsten. 2022. „Synchronously Pumped Tantalum Pentoxide Waveguide-based Optical Parametric Oscillator.“ In Proceedings of 10th EPS-QEOD Europhoton Conference on Solid-State, Fibre, and Waveguide Coherent Light Sources (EUROPHOTON 2022), herausgegeben von P Helfenstein. Les Ulis: EDP Sciences. doi: 10.1051/epjconf/202226702024.
Linnenbrügger, L; Doering, L; Lansing, H; Fischer, K; Eirich, J; Finkemeier, I; von Schaewen, A. 2022. „Alternative splicing of Arabidopsis G6PD5 recruits NADPH-producing OPPP reactions to the endoplasmic reticulum.“ Frontiers in Plant Science 13 909624. doi: 10.3389/fpls.2022.909624.
Nyenhuis, M, Schönrath, I, Kamzeeva, PN, Zatsepin, TS, Müller, J, Doltsinis, N, und Aralov, AV. 2022. „Benzothiazole-substituted 1,3‑diaza‑2‑oxophenoxazine as a luminescent nucleobase surrogate for silver(I)-mediated base pairing.“ Dalton Transactions 51: 13386–13395. doi: 10.1039/d2dt01762h.
Danzer, Moritz Fabian, Feld, Jannik, Faldum, Andreas, und Schmidt, Rene. 2022. „Reference curve sampling variability in one–sample log–rank tests.“ PloS one 17 (7) e0271094. doi: 10.1371/journal.pone.0271094.
Danzer, Moritz Fabian, Faldum, Andreas, und Rene, Schmidt. 2022. „On Variance Estimation for the One-Sample Log-Rank Test.“ Statistics in Biopharmaceutical Research 2022. doi: 10.1080/19466315.2022.2081600.
Fiaschi, J, Fuks, B, Klasen, M, und Neuwirth, A. 2022. „Soft gluon resummation for associated squark-electroweakino production at the LHC.“ Journal of High Energy Physics (JHEP) 06: 130–130. doi: 10.1007/JHEP06(2022)130.
Maisuls, I., Boisten, F., Hebenbrock, M., Alfke, J., Schürmann, L., Jasper-Peter, B., Hepp, A., Esselen, M., Müller, J., und Strassert, C.A. 2022. „Monoanionic C^N^N Luminophores and Monodentate C-Donor Co-Ligands for Phosphorescent Pt(II) Complexes: A Case Study Involving Their Photophysics and Cytotoxicity.“ Inorganic Chemistry 61 (24): 9195–9204. doi: 10.1021/acs.inorgchem.2c00753.
Dr., Julia Sindlinger, Stefan, Schön, Dr., Jürgen Eirich, Dr., Sören Kirchgäßner, Prof. Dr., Iris Finkemeier, und Prof. Dr., Dirk Schwarzer. 2022. „Investigating Peptide‐Coenzyme A Conjugates as Chemical Probes for Proteomic Profiling of N‐Terminal and Lysine Acetyltransferases.“ ChemBioChem 23. doi: 10.1002/cbic.202200255.
Leibner Tobias. 2022. „Model reduction for kinetic equations: moment approximations and hierarchical approximate proper orthogonal decomposition.“ Dissertationsschrift, Universität Münster.
Kleine, Bardenhorst S, Vital, M, Karch, A, und Rübsamen, N. 2022. „Richness estimation in microbiome data obtained from denoising pipelines.“ Computational and Structural Biotechnology Journal 20: 508–520. doi: 10.1016/j.csbj.2021.12.036.
Bernges, Tim, Böger, Thorben, Maus, Oliver, Till, Paul S., Agne, Matthias T., und Zeier, Wolfgang G. 2022. „Scaling Relations for Ionic and Thermal Transport in the Na+ Ionic Conductor Na3PS4.“ ACS Materials Letters 4 (12): 2491–2498. doi: 10.1021/acsmaterialslett.2c00846.
Wettstein, Alina, Diddens, Diddo, und Heuer, Andreas. 2022. „Controlling Li+ transport in ionic liquid electrolytes through salt content and anion asymmetry: a mechanistic understanding gained from molecular dynamics simulations.“ Physical Chemistry Chemical Physics 24 (10): 6072–6086. doi: 10.1039/d1cp04830a.
Banholzer, S, Keil, T, Mechelli, L, Ohlberger, M, Schindler, F, und Volkwein, S. 2022. „An adaptive projected Newton non-conforming dual approach for trust-region reduced basis approximation of PDE-constrained parameter optimization.“ Pure and Applied Functional Analysis 7 (5): 1561–1596.
Wolff, R, Hölzer, K, Hetzel, R, Xu, Q, Dunkl, I.Anczkiewicz AA, und Li, Z. 2022. „Spatially focused erosion in the High Himalaya and the geometry of the Main Himalayan Thrust in Central Nepal (85°E) from thermo-kinematic modeling of thermochronological data in the Gyirong region (southern China).“ Tectonophysics 834: 229378. doi: 10.1016/j.tecto.2022.229378.
Mila, C, Mateu, J, Pebesma, E, und Meyer, H. 2022. „Nearest neighbour distance matching leave-one-out cross-validation for map validation.“ Methods in Ecology and Evolution 13: 1304–1316. doi: 10.1111/2041-210X.13851.
Blossier, B., Cahue, P.-H., Heitger, J., La Cesa, S., Neuendorf, J., und Zafeiropoulos, S. 2022. „On the extraction of B_s to D^(*)_s form factors from N_f=2 lattice QCD.“ Physical Review D (PRD) 105 (5): 054515. doi: 10.1103/PhysRevD.105.054515.
Raghuraman, S, Schubert, AS, Bröker, S, Jurado, A, Müller, A, Brandt, M, Vos, BE, Hofemeier, AD, Abbasi, F, Stehling, M, Wittkowski, R, Ivaska, J, und Betz, T. 2022. „Pressure drives rapid burst-like coordinated cellular motion from 3D cancer aggregates.“ Advanced Science 9 (6): 2104808.. doi: 10.1002/advs.202104808.
Balparda, M, Elsässer, M, Badia, MB, Giese, J, Bovdilova, A, Hüdig, M, Reinmuth, L, Eirich, J, Schwarzländer, M, Finkemeier, I, Schallenberg-Rüdinger, M, und Maurino, VG. 2022. „Acetylation of conserved lysines fine-tunes mitochondrial malate dehydrogenase activity in land plants.“ The Plant journal 109 (1): 92–111. doi: 10.1111/tpj.15556.
Voß, J, und Wittkowski, R. 2022. „Acoustically propelled nano- and microcones: fast forward and backward motion.“ Nanoscale Advances 4 (1): 281–293. doi: 10.1039/D1NA00655J.
Bohl, Martin T., Branger, Nicole, und Trede, Mark. 2022. „Measurement Errors in Index Trader Positions Data: Is the Price Pressure Hypothesis Still Invalid?“ Applied Economic Perspectives and Policy 44 (3): 1534–1553. doi: 10.1002/aepp.13186.
Strieth-Kalthoff, Felix, Sandfort, Frederik, Kühnemund, Marius, Schäfer, Felix R., Kuchen, Herbert, und Glorius, Frank. 2022. „Machine Learning for Chemical Reactivity: The Importance of Failed Experiments.“ Angewandte Chemie International Edition 61 (29) e202204647. doi: 10.1002/anie.202204647.
Singh, A, Thale, S, Leibner, T, Ricker, A, Nüsse, H, Klingauf, J, Ohlberger, M, und Matis, M. 2022. „Dynamic interplay of protrusive microtubule and contractile actomyosin forces drives tissue extension.“ eLife 2022. doi: 10.1101/2022.06.21.496930.
Kirchhoff, Alexander; Deilmann, Thorsten; Krüger, Peter; Rohlfing, Michael. 2022. „Electronic and optical properties of a hexagonal boron nitride monolayer in its pristine form and with point defects from first principles.“ Physical Review B 2022/106. doi: 10.1103/PhysRevB.106.045118.
Czuppon, Peter, und Billiard, Sylvain. 2022. „Revisiting the number of self-incompatibility alleles in finite populations: From old models to new results.“ Journal of Evolutionary Biology 35 (10): 1296–1308. doi: 10.1111/jeb.14061.
Voß, Johannes, und Wittkowski, Raphael. 2022. „Orientation-dependent propulsion of triangular nano- and microparticles by a traveling ultrasound wave.“ ACS Nano 16 (3): 3604–3612. doi: 10.1021/acsnano.1c02302.
Voß, Johannes, und Wittkowski, Raphael. 2022. „Propulsion of bullet- and cup-shaped nano- and microparticles by traveling ultrasound waves.“ Physics of Fluids 34 (5) 052007. doi: 10.1063/5.0089367.
Bickmann, Jens, Bröker, Stephan, Jeggle, Julian, und Wittkowski, Raphael. 2022. „Analytical approach to chiral active systems: suppressed phase separation of interacting Brownian circle swimmers.“ Journal of Chemical Physics 156 (19) 194904. doi: 10.1063/5.0085122.
Nitschke, Tobias, Stenhammar, Joakim, und Wittkowski, Raphael. 2022. „Collective guiding of acoustically propelled nano- and microparticles.“ Nanoscale Advances 4 (13): 2844–2856. doi: 10.1039/D2NA00007E.
Voß, Johannes, und Wittkowski, Raphael. 2022. „Acoustic propulsion of nano- and microcones: dependence on the viscosity of the surrounding fluid.“ Langmuir 38 (35): 10736–10748. doi: 10.1021/acs.langmuir.2c00603.
te Vrugt, M, Holl, MP, Koch, A, Wittkowski, R, und Thiele, U. 2022. „Derivation and analysis of a phase field crystal model for a mixture of active and passive particles.“ Modelling and Simulation in Materials Science and Engineering 30 (8) 084001. doi: 10.1088/1361-651X/ac856a.
Krawitz, J, Schukajlow, S, Kanefke, J, und Rakoczy, K. 2022. „Making realistic assumption in mathematical modelling.“ In Proceedings of the 45th Conference of the International Group for the Psychology of Mathematics Education, herausgegeben von Llinares et al. Fernandez. Spain: PME.
Evers, Marina, Wittkowski, Raphael, und Linsen, Lars. 2022. „ASEVis: Visual Exploration of Active System Ensembles to Define Characteristic Measures.“ In 2022 IEEE Visualization and Visual Analytics (VIS), herausgegeben von - Oklahoma City: Wiley-IEEE Press. doi: 10.1109/VIS54862.2022.00039.
Klink, BU, Herrmann, E, Antoni, C, Langemeyer, L, Kiontke, S, Gatsogiannis, C, Ungermann, C, Raunser, S, und Kümmel, D. 2022. „Structure of the Mon1-Ccz1 complex reveals molecular basis of membrane binding for Rab7 activation.“ Proceedings of the National Academy of Sciences of the United States of America 119 (6). doi: 10.1073/pnas.2121494119.
Boyle, Peter, Heitger, Jochen, und al., et. 2022. „A lattice QCD perspective on weak decays of bb and cc quarks Snowmass 2022 White Paper.“ Preprint. Beitrag präsentiert auf der 2022 Snowmass Summer Study, Washington U., Seattle, Seattle, WA, United States
Petrak, Pia, Bali, Gunnar, Collins, Sara, Heitger, Jochen, und Jenkins, Daniel Weißhäupl Simon. 2022. „Sigma terms of the baryon octet in N_f=2+1 QCD with Wilson quarks.“ Preprint. Beitrag präsentiert auf der 39th International Symposium on Lattice Field Theory (Lattice 2022), Bonn, Germany doi: 10.48550/arXiv.2301.03871.
Neuendorf, Jan, Heitger, Jochen, José, Teseo San, und Blossier, Benoît. 2022. „Direct access to hadronic decay parameters with twisted boundary conditions.“ Beitrag präsentiert auf der 39th International Symposium on Lattice Field Theory (Lattice 2022), Bonn, Germany doi: 10.48550/arXiv.2212.11206.
Schroeder, Christian, Lew, Christopher M., Zones, Stacey I., und Koller, Hubert. 2022. „Ordered Heteroatom Siting Preserved By B/Al Exchange in Zeolites.“ Chemistry of Materials 34: 3479–3488. doi: 10.1021/acs.chemmater.2c00359.
Magdalena, Füßl, Ann-Christine, König, Jürgen, Eirich, Markus, Hartl, Laura, Kleinknecht, Alexandra-Viola, Bohne, Anne, Harzen, Katharina, Kramer, Dario, Leister, Jörg, Nickelsen, und Iris, Finkemeier. 2022. „Dynamic light‐ and acetate‐dependent regulation of the proteome and lysine acetylome of Chlamydomonas.“ The Plant journal 109 (1): 261–277. doi: 10.1111/tpj.15555.
Neusius, D., Kleinknecht, L., Teh, J.T., Ostermeier, M., Kelterborn, S., Eirich, J., Hegemann, P., Finkemeier, I., Bohne, A.V., und Nickelsen, J. 2022. „Lysine acetylation regulates moonlighting activity of the E2 subunit of the chloroplast pyruvate dehydrogenase complex in Chlamydomonas.“ The Plant journal 111 (6): 1780–1800. doi: 10.1111/tpj.15924.
Schroeder C, Zones, SI, Hansen, und MR, Koller H. 2022. „Hydrogen Bonds Dominate Brønsted Acid Sites in Zeolite SSZ-42 – A Classification of Their Diversity.“ Angewandte Chemie International Edition 61 e202109313. doi: 10.1002/anie.202109313.
2021
Bonin, M, Hameleers, L, Hembach, L, Roret, T, Cord-Landwehr, S, Michel, G, und Moerschbacher, B. 2021. „In silico and in vitro analysis of an Aspergillus niger chitin deacetylase to decipher its subsite sugar preferences.“ Journal of Biological Chemistry 297 (4): 101129.. doi: 10.1016/j.jbc.2021.101129.
Timmerkamp, M, Lüpken, NM, Scheibinger, R, Schaarschmidt, K, Schmidt, MA, Boller, K-J, und Fallnich, C. 2021. „Frequency Conversion by Intermodal Dispersive Wave Generation.“ Beitrag präsentiert auf der Advanced Photonics Congress, Washington, DC, United States
Danzer, MF, Terzer, T, Berthold, F, Faldum, A, und Schmidt, R. 2021. „Confirmatory adaptive group sequential designs for single-arm phase II studies with multiple time-to-event endpoints.“ Biometrical Journal 2021. doi: 10.1002/bimj.202000205.
Timmerkamp, M, Lüpken, NM, Scheibinger, R, Schaarschmidt, K, Schmidt, MA, Boller, K-J, und Fallnich, C. 2021. „Generation of Dispersive Waves via Intermodal Cross-phase Modulation.“ Beitrag präsentiert auf der CLEO/Europe-EQEC, Munich, Germany doi: 10.1109/CLEO/Europe-EQEC52157.2021.9541887.
Timmerkamp, M, Lüpken, NM, Scheibinger, R, Schaarschmidt, K, Schmidt, MA, Boller, K-J, und Fallnich, C. 2021. „Dispersive Wave Generation via Intermodal Cross-phase Modulation.“ Beitrag präsentiert auf der Conference on Lasers and Electro-Optics, San Jose, USA doi: 10.1364/CLEO_AT.2021.JW1A.13.
Menezes, Breno, Herrmann, Nina, Kuchen, Herbert, und Neto, Fernando Buarque de Lima. 2021. „High-Level Parallel Ant Colony Optimization with Algorithmic Skeletons.“ International Journal of Parallel Programming 49: 776–801. doi: 10.1007/s10766-021-00714-1.
Liu, L., Klaasen, H., Witteler, M.C., Schulze Lammers, B., Timmer, A., Kong, H., Mönig, H., Gao, H.-Y., Neugebauer, J., Fuchs, H., und Studer, A. 2021. „Polymerization of Silanes through Dehydrogenative Si–Si Bond Formation on Metal Surfaces.“ Nature Chemistry 13: 350–357. doi: 10.1038/s41557-021-00651-z.
Biehl, JL, Paas, B, und Klemm, O. 2021. „Ventilation of a Mid-Size City under Stable Boundary Layer Conditions: A Simulation Using the LES Model PALM.“ Atmosphere 12 (401). doi: 10.3390/atmos12030401.
de Lacerda, MG, de Araujo, Pessoa L F, Buarque, de Lima Neto F, Ludermir, TB, und Kuchen, H. 2021. „A Systematic Literature Review on General Parameter Control for Evolutionary and Swarm-based Algorithms.“ In Swarm and Evolutionary Computation, herausgegeben von S Das, PN Suganthan und M Ali. doi: 10.1016/j.swevo.2020.100777.
Lüpken, NM, Timmerkamp, M, Scheibinger, R, Schaarschmidt, K, Schmidt, MA, Boller, K-J, und Fallnich, C. 2021. „Numerical and experimental demonstration of intermodal dispersive wave generation.“ Laser and Photonics Reviews 19 (5). doi: 10.1002/lpor.202100125.
te, Vrugt Michael, Bickmann, Jens, und Wittkowski, Raphael. 2021. „Containing a pandemic: nonpharmaceutical interventions and the 'second wave'.“ Journal of Physics Communications 5 (5): 055008.. doi: 10.1088/2399-6528/abf79f.
Meyer, H, und Pebesma, E. 2021. „Predicting into unknown space? Estimating the area of applicability of spatial prediction models.“ Methods in Ecology and Evolution 12: 1620–1633. doi: 10.1111/2041-210X.13650.
Borisenko, Andrey, und Gorlatch, Sergei. 2021. „Efficient GPU-parallelization of batch plants design using metaheuristics with parameter tuning.“ Journal of Parallel and Distributed Computing 154: 74–81. doi: 10.1016/j.jpdc.2021.03.012.
Uflewski, M, Mielke, S, Corre, GV, vo, BT, Chen, X, Tietz, E, Ruß, J, Luzarowski, M, Sokolowska, E, Skirycz, A, Eirich, J, Finkemeier, I, Schöttler, MA, und Armbruster, U. 2021. „Functional characterization of protonantiport regulation in the thylakoid membrane.“ Plant Physiology 187. doi: 10.1093/plphys/kiab135.
Dreier Nils-Arne. 2021. „Hardware-Oriented Krylov Methods for High-Performance Computing.“ Dissertationsschrift, WWU Münster. doi: 10.48550/arXiv.2104.02494.
Henzler, P, Traum, C, Holtkemper, M, Nabben, D, Erbe, M, Reiter, DE, Kuhn, T, Mahapatra, S, Brunner, K, Seletskiy, DV, und Leitenstorfer, A. 2021. „Femtosecond Transfer and Manipulation of Persistent Hot-Trion Coherence in a Single CdSe/ZnSe Quantum Dot.“ Phys. Rev. Lett. 126: 067402.. doi: 10.1103/PhysRevLett.126.067402.
Holtkemper, M, Quinteiro, GF, Reiter, DE, und Kuhn, T. 2021. „Dark exciton preparation in a quantum dot by a longitudinal light field tuned to higher exciton states.“ Physical Review Research 3: 013024. doi: 10.1103/PhysRevResearch.3.013024.
Rasch, Ari, Schulze, Richard, Steuwer, Michel, und Gorlatch, Sergei. 2021. „Efficient Auto-Tuning of Parallel Programs with Interdependent Tuning Parameters via Auto-Tuning Framework (ATF).“ Transactions on Architecture and Code Optimization 18 (1): 1–26. doi: 10.1145/3427093.
Maas, C., Manske, L., Wünnemann, K., und Hansen, U. 2021. „On the fate of impact-delivered metal in a terrestrial magma ocean.“ Earth and Planetary Science Letters 554. doi: 10.1016/j.epsl.2020.116680.
Mariscal, CJL, Classen, L, Elorrieta, MAU, und Kappes, A. 2021. „Sensitivity of multi-PMT optical modules in Antarctic ice to supernova neutrinos of MeV energy.“ Eur. Phys. J. C 81 (12): 1058.. doi: 10.1140/epjc/s10052-021-09809-y.
Heitger, J., und Joswig, F. 2021. „The renormalised O(a) improved vector current in three-flavour lattice QCD with Wilson quarks.“ The European Physical Journal C 81 (3): 254.. doi: 10.1140/epjc/s10052-021-09037-4.
Heitger, J., Joswig, F., und Kuberski, S. 2021. „Determination of the charm quark mass in lattice QCD with 2+1 flavours on fine lattices.“ Journal of High Energy Physics (JHEP) 05: 288.. doi: 10.1007/JHEP05(2021)288.
Heitger, J., Joswig, F., Petrak, P.L.J., und Vladikas, A. 2021. „Ratio of flavour non-singlet and singlet scalar density renormalisation parameters in N_f=3 QCD with Wilson quarks.“ The European Physical Journal C 81 (7): 606.. doi: 10.1140/epjc/s10052-021-09387-z.
Cali, S., Eckert, K., Heitger, J., Knechtli, F., und Korzec, T. 2021. „Charm sea effects on charmonium decay constants and heavy meson masses.“ The European Physical Journal C 81 (8): 733.. doi: 10.1140/epjc/s10052-021-09520-y.
Gérardin, A., Heitger, J., Kuberski, S., Simma, H., und Sommer, R. 2021. „Precision $B^*Bπ$ coupling from three-flavor lattice QCD.“ In Proceedings of the 38th International Symposium on Lattice Field Theory, PoS SISSA. doi: 10.48550/arXiv.2111.04693.
Blossier, B., Cahue, P.-H., Heitger, J., La Cesa, S., Neuendorf, J., und Zafeiropoulos, S. 2021. „B_s to D^(*)_s form factors from lattice QCD with N_f=2 Wilson-clover quarks.“ In Proceedings of the 38th International Symposium on Lattice Field Theory, PoS SISSA. doi: 10.48550/arXiv.2111.05733.
Petrak, P.L.J., Bali, G., Collins, S., Heitger, J., Jenkins, D., Weishäupl, S., und Wurm, T. 2021. „Towards the determination of sigma terms for the baryon octet on N_f=2+1 CLS ensembles.“ In Proceedings of the 38th International Symposium on Lattice Field Theory, PoS SISSA. doi: 10.48550/arXiv.2112.00586.
Lengers, F, Kuhn, T, und Reiter, DE. 2021. „Phonon signatures in spectra of exciton polaritons in transition metal dichalcogenides.“ Physical Review B 104: L241301.. doi: 10.1103/PhysRevB.104.L241301.
Jürgens, K., Lengers, F., Groll, D., Reiter, D.E., Wigger, D., und Kuhn, T. 2021. „Comparison of the semiclassical and quantum optical field dynamics in a pulse-excited optical cavity with a finite number of quantum emitters.“ Physical Review B 104: 205308.. doi: 10.1103/PhysRevB.104.205308.
te, Vrugt M, Tóth, GI, und Wittkowski, R. 2021. „Master equations for Wigner functions with spontaneous collapse and their relation to thermodynamic irreversibility.“ Journal of Computational Electronics 20 (6): 2209–2231. doi: 10.1007/s10825-021-01804-6.
Siebel, C, Lanvers-Kaminsky, C, Alten, J, Smisek, P, Nath, CE, Rizzari, C, Boos, J, und Würthwein, G. 2021. „Impact of Antibodies Against Polyethylene Glycol on the Pharmacokinetics of PEGylated Asparaginase in Children with Acute Lymphoblastic Leukaemia: A Population Pharmacokinetic Approach.“ European Journal of Drug Metabolism and Pharmacokinetics 2021. doi: 10.1007/s13318-021-00741-w.
Eschmann, L, Neuendorf, J, und Rohlfing, M. 2021. „Graphene and NTCDA adsorbed on Ag(111): Temperature-dependent binding distance and phonon coupling to the interface state.“ Phys. Rev. B 104: 245403.. doi: 10.1103/PhysRevB.104.245403.
Eschmann, L, Neuendorf, J, und Rohlfing, M. 2021. „Impact of electron-phonon interaction on metal-organic interface states.“ Phys. Rev. B 104: L241102.. doi: 10.1103/PhysRevB.104.L241102.
Toelle, J, Deilmann, T, Rohlfing, M, und Neugebauer, J. 2021. „Subsystem-Based GW/Bethe-Salpeter Equation.“ Journal of Chemical Theory and Computation 17 (4): 2186–2199. doi: 10.1021/acs.jctc.0c01307.
Hessenbuettel, M, Deilmann, T, Krueger, P, und Rohlfing, M. 2021. „Valley-Dependent Interlayer Excitons in Magnetic WSe2/CrI3.“ Nano Letters 21 (12): 5173–5178. doi: 10.1021/acs.nanolett.1c01232.
Osthues, H, Schwermann, C, Preuss, JA, Deilmann, T, Bratschitsch, R, Rohlfing, M, und Doltsinis, NL. 2021. „Covalent photofunctionalization and electronic repair of 2H-MoS(2)via nitrogen incorporation.“ Physical Chemistry Chemical Physics 23 (34): 18517–18524. doi: 10.1039/d1cp02313f.
Lettmann, T, und Rohlfing, M. 2021. „Finite-momentum excitons in rubrene single crystals.“ Physical Review B 104 (11). doi: 10.1103/PhysRevB.104.115427.
Ali, S, Bergner, G, López, C, Montvay, I, Münster, G, und Piemonte, S. 2021. „Estimates for the lightest baryon masses in N=1 supersymmetric Yang-Mills theory.“ In Proceedings of the 38th International Symposium on Lattice Field Theory (Lattice 2021), Bd. PoS(LATTICE2021) aus Proceedings of Science Proceedings of Science.
Biedermann, M, Diddens, D, und Heuer, A. 2021. „rs@ md: Introducing Reactive Steps at the Molecular Dynamics Simulation Level.“ Journal of Chemical Theory and Computation 17 (2): 1074–1085. doi: 10.1021/acs.jctc.0c01189.
Wettstein, A, Diddens, D, und Heuer, A. 2021. „Polymer electrolytes in strong external electric fields: Modification of structure and dynamics.“ Macromolecules 54 (5): 2256–2265. doi: 10.1021/acs.macromol.0c02385.
Wölke, Christian, Diddens, Diddo, Heidrich, Bastian, Winter, Martin, und Cekic-Laskovic, Isidora. 2021. „Understanding the Effectiveness of Phospholane Electrolyte Additives in Lithium-Ion Batteries under High-Voltage Conditions.“ ChemElectroChem 8 (5): 972–982. doi: 10.1002/celc.202100107.
Otero-Mato, JM, Rivera-Pousa, A, Montes-Campos, H, Cabeza, O, Heuer, A, Diddens, D, und Varela, LM. 2021. „Computational study of the structure of ternary ionic liquid/salt/polymer electrolytes based on protic ionic liquids.“ Journal of Molecular Liquids 333: 115883.. doi: 10.1016/j.molliq.2021.115883.
Perner, V, Diddens, D, Otteny, F, Küpers, V, Bieker, P, Esser, B, Winter, M, und Kolek, M. 2021. „Insights into the Solubility of Poly (vinylphenothiazine) in Carbonate-Based Battery Electrolytes.“ ACS applied materials & interfaces 13 (10): 12442–12453. doi: 10.1021/acsami.0c20012.
Atik, J, Diddens, D, Thienenkamp, JH, Brunklaus, G, Winter, M, und Paillard, E. 2021. „Cation-Assisted Lithium-Ion Transport for High-Performance PEO-based Ternary Solid Polymer Electrolytes.“ Angewandte Chemie International Edition 60 (21): 11919–11927.
Biedermann, M, Diddens, D, und Heuer, A. 2021. „Connecting the quantum and classical mechanics simulation world: Applications of reactive step molecular dynamics simulations.“ The Journal of Chemical Physics 154 (19): 194105.. doi: 10.1063/5.0048618.
Gardam Giles. 2021. „A counterexample to the unit conjecture for group rings.“ Annals of Mathematics 194 (3): 967–979. doi: 10.4007/annals.2021.194.3.9.
Leibner, T, Matis, M, Ohlberger, M, und Rave, S. 2021. „Distributed model order reduction of a model for microtubule-based cell polarization using HAPOD.“ arXiv [math.NA] 2111.00129.
Abadeer, M, Magharious, S, und Gorlatch, S. 2021. „Introducing Interactivity in Disaster Recovery Simulations.“ In New Trends in Intelligent Software Methodologies, Tools and Techniques, Frontiers in Artificial Intelligence and Applications, herausgegeben von H Fujita und H Perez-Meana. Amsterdam: IOS Press. doi: 10.3233/FAIA210026.
Kucher, V, und Gorlatch, S. 2021. „Implicit Data Layout Optimization for Portable Parallel Programming in C++.“ In Parallel Computing Technologies, Bd. 12942 aus Lecture Notes in Computer Science, herausgegeben von V Malyshkin. Cham: Springer. doi: 10.1007/978-3-030-86359-3_17.
Würthwein, G, Lanvers-Kaminsky, C, Siebel, C, Gerß, J, Möricke, A, Zimmermann, M, Stary, J, Smisek, P, Schrappe, M, Rizzari, C, Zucchetti, M, Hempel, G, Wicha, SG, und Boos, J. 2021. „Population Pharmacokinetics of PEGylated Asparaginase in Children with Acute Lymphoblastic Leukemia: Treatment Phase Dependency and Predictivity in Case of Missing Data.“ European Journal of Drug Metabolism and Pharmacokinetics 46 (2): 289–300. doi: 10.1007/s13318-021-00670-8.
Rugen, N., Schaarschmidt, F., Eirich, J., Finkemeier, I., Braun, H.P., und Eubel, H. 2021. „Protein interaction patterns in Arabidopsis thaliana leaf mitochondria change in dependence to light.“ BBA - Bioenergetics 1862 (8). doi: 10.1016/j.bbabio.2021.148443.
Rose, J., Müller, B., Groscurth, S., Giese, J., Eirich, J., Finkemeier, I., Twyman, R.M., Prüfer, D., und Noll, G.A. 2021. „The functionality of plant mechanoproteins (forisomes) is dependent on the dual role of conserved cysteine residues.“ International Journal of Biological Macromolecules 193: 1332–1339. doi: 10.1016/j.ijbiomac.2021.10.192.
Bastian, P, Blatt, M, Dedner, A, Dreier, N, Engwer, C, Fritze, R, Gräser, C, Kempf, D, Klöfkorn, R, Ohlberger, M, und Sander, O. 2021. „The DUNE Framework: Basic Concepts and Recent Developments.“ Computers & Mathematics with Applications 81: 75–112. doi: 10.1016/j.camwa.2020.06.007.
Meng, X, Klaasen, H, Viergutz, L, Schulze, Lammers B, Witteler, MC, Mönig, H, Amirjalayer, S, Liu, L, Neugebauer, J, Gao, H, Studer, A, und Fuchs, H. 2021. „Azo bond formation on metal surfaces.“ Angewandte Chemie International Edition 60 (3): 1458–1464. doi: 10.1002/anie.202011858.
Brunk, Jens, Stierle, Matthias, Papke, Leon, Revoredo, Kate, Matzner, Martin, und Becker, Jörg. 2021. „Cause vs. Effect in Context-Sensitive Prediction of Business Process Instances.“ Information Systems 95 (1). doi: 10.1016/j.is.2020.101635.
2020
Menezes, Breno, Herrmann, Nina, Kuchen, Herbert, und Neto, Fernando Buarque de Lima. 2020. „High-Level Parallel Ant Colony Optimization with Algorithmic Skeletons.“ Beitrag präsentiert auf der 13th International Symposium on High-Level Parallel Programming and Applications (HLPP 2020), Porto, Portugal Springer.
Danielova-Zaharieva, Martina, Trede, Mark, und Wilfling, Bernd. 2020. „Bayesian semiparametric multivariate stochastic volatility with application.“ Econometric Reviews 39 (9): 947–970. doi: 10.1080/07474938.2020.1761152.
Niehues, I, Marauhn, P, Deilmann, T, Wigger, D, Schmidt, R, Arora, A, Michaelis, de Vasconcellos S, Rohlfing, M, und and, Bratschitsch R. 2020. „Strain tuning of the Stokes shift in atomically thin semiconductors.“ Nanoscale 12 (40): 20786–20796. doi: 10.1039/D0NR04557H.
Bienvenut, WV, Brünje, A, Boyer, J, Mühlenbeck, JS, Bernal, G, Lassowskat, I, Dian, C, Linster, E, Dinh, TV, Koskela, MM, Jung, V, Seidel, J, Schyrba, LK, Ivanauskaite, A, Eirich, J, Hell, R, Schwarzer, D, Mulo, P, Wirtz, M, Meinnel, T, Giglione, C, und Finkemeier, I. 2020. „Dual lysine and N-terminal acetyltransferases reveal the complexity underpinning protein acetylation.“ Molecular Systems Biology 16 (7): e9464. doi: 10.15252/msb.20209464.
Arora, A, Wessling, NK, Deilmann, T, Reichenauer, T, Steeger, P, Kossacki, P, Potemski, M, Michaelis, de Vasconcellos S, Rohlfing, M, und and, Bratschitsch R. 2020. „Dark trions govern the temperature-dependent optical absorption and emission of doped atomically thin semiconductors.“ Physical Review B 101 (24). doi: 10.1103/PhysRevB.101.241413.
Forthmann, B, und Runco, MA. 2020. „An Empirical Test of the Inter-Relationships between Various Bibliometric Creative Scholarship Indicators.“ Publications 8 (2): 34. doi: 10.3390/publications8020034.
Koppe, J, und Hansen, MR. 2020. „Minimizing Lineshape Distortions in Static Ultra-wideline Nuclear Magnetic Resonance of Half-Integer Spin Quadrupolar Nuclei.“ J. Phys. Chem. A 124 (21): 4314–4321. doi: 10.1021/acs.jpca.0c03658.
Schroeder, C., Mück-Lichtenfeld, C., Xu, L., Grosso-Giordano, N.A., Okrut, A., Chen, C.Y., Zones, S.I., Katz, A., Hansen, M.R., und Koller, H. 2020. „A Stable Silanol Triad in the Zeolite Catalyst SSZ-70.“ Angewandte Chemie International Edition 59: 10939 –10943.. doi: 10.1002/anie.202001364.
Pessoa, Luis Filipe, Hellingrath, Bernd, und Buarque, Fernando. 2020. „On the Sensitivity Analysis of Cartesian Genetic Programming Hyper-Heuristic.“ In Proceedings of the 2020 Genetic and Evolutionary Computation Conference Companion, GECCO '20 New York, NY, USA: ACM Press. doi: 10.1145/3377929.3398142.
Pessoa, Luis Filipe, Hellingrath, Bernd, und Buarque, Fernando. 2020. „Cartesian Genetic Programming Hyper-Heuristic with Parameter Configuration for Production Lot-Sizing.“ In 2020 IEEE Congress on Evolutionary Computation (CEC) doi: 10.1109/CEC48606.2020.9185602.
Voß, J, und Wittkowski, R. 2020. „On the shape-dependent propulsion of nano- and microparticles by traveling ultrasound waves.“ Nanoscale Advances 2 (9): 3890–3899. doi: 10.1039/D0NA00099J.
Wöste, Marius, Leitão, Elsa, Laurentino, Sandra, Horsthemke, Bernhard, Rahmann, Sven, und Schröder, Christopher. 2020. „wg-blimp: an end-to-end analysis pipeline for whole genome bisulfite sequencing data.“ BMC Bioinformatics 2020. doi: 10.1186/s12859-020-3470-5.
Deilmann, T, Krüger, P, und Rohlfing, M. 2020. „Ab Initio Studies of Exciton g Factors: Monolayer Transition Metal Dichalcogenides in Magnetic Fields.“ Physical Review Letters 124 (22): 226402.. doi: 10.1103/PhysRevLett.124.226402.
Deilmann, T, Rohlfing, M, und Wurstbauer, U. 2020. „Light--matter interaction in van der Waals hetero-structures.“ Journal of Physics: Condensed Matter 32 (33): 333002.. doi: 10.1088/1361-648x/ab8661.
Eickhoff, F, Kolodzeiski, E, Esat, T, Fournier, N, Wagner, C, Deilmann, T, Temirov, R, Rohlfing, M, Tautz, FS, und Anders, FB. 2020. „Inelastic electron tunneling spectroscopy for probing strongly correlated many-body systems by scanning tunneling microscopy.“ Physical Review B 101 (12): 125405.. doi: 10.1103/PhysRevB.101.125405.
Deilmann, T. 2020. „Valley selectivity induced by magnetic adsorbates: Triplet oxygen on monolayer MoS2.“ Physical Review B 101 (8): 085130.. doi: 10.1103/PhysRevB.101.085130.
Heitger, J., Joswig, F., und Vladikas, A. 2020. „Ward identity determination of Z_S/Z_P for N_f=3 lattice QCD in a Schrödinger functional setup.“ The European Physical Journal C 80 (8) 765. doi: 10.1140/epjc/s10052-020-8266-2.
Chimirri, L., Fritzsch, P., Heitger, J., Joswig, F., Panero, M., Pena, C., und Preti, D. 2020. „Non-perturbative renormalization of O(a) improved tensor currents.“ In Lattice 2019, Bd. PoS LATTICE2019 aus Proceedings of Science Proceedings of Science.
Ren, Jindong, Klaasen, Henning, Witteler, Melanie C., Viergutz, Lena, Neugebauer, Johannes, Gao, Hong-Ying, Studer, Armido, und Fuchs, Harald. 2020. „Aryl Triflates in On-Surface Chemistry.“ Chemistry – A European Journal n/a. doi: 10.1002/chem.202002486.
Churakov, G, Zhang, F, Grundmann, N, Makalowski, W, Noll, A, Doronina, L, und Schmitz, J. 2020. „The multi-comparative 2-n-way genome suite.“ Genome Research 30. doi: 10.1101/gr.262261.120.
Lengers, F, Kuhn, T, und Reiter, D. 2020. „Theory of the absorption line shape in monolayers of transition metal dichalcogenides.“ Physical Review B 101 (15): 155304.. doi: 10.1103/PhysRevB.101.155304.
Fedkevych, Oleh, und Lönnblad, Leif. 2020. „Four-jet double parton scattering production in proton-nucleus collisions within the pythia8 framework.“ Physical Review D - Particles, Fields, Gravitation, and Cosmology 102 (1): 014029.. doi: 10.1103/PhysRevD.102.014029.
Hagedorn, Bastian, Lenfers, Johannes, Koehler, Thomas, Qin, Xueying, Gorlatch, Sergei, und Steuwer, Michel. 2020. „Achieving High-Performance the Functional Way: A Functional Pearl on Expressing High-Performance Optimizations as Rewrite Strategies.“ In Proceedings of the ACM on Programming Languages, Bd. ICFP aus 4 USA.
Rasch, A, Schulze, R, und Gorlatch, S. 2020. „md_poly: A Performance-Portable Polyhedral Compiler Based on Multi-Dimensional Homomorphisms.“ Beitrag präsentiert auf der 10th International Workshop on Polyhedral Compilation Techniques, Bologna
Ali, S, Bergner, G, Gerber, H, Montvay, I, Münster, G, Piemonte, S, und Scior, P. 2020. „Continuum extrapolation of Ward identities in N=1 supersymmetric SU(3) Yang-Mills theory.“ European Physical Journal C: Particles and Fields 80: 548. doi: 10.1140/epjc/s10052-020-8113-5.
Ali, S, Bergner, G, Gerber, H, Lopez, C, Montvay, I, Münster, G, Piemonte, S, und Scior, P. 2020. „Continuum limit of SU(3) N=1 supersymmetric Yang-Mills theory and supersymmetric gauge theories on the lattice.“ In Proceedings of the 37th International Symposium on Lattice Field Theory (Lattice 2019), Bd. PoS(LATTICE2019) aus Proceedings of Science Proceedings of Science.
Masuhr, Andreas, und Trede, Mark. 2020. „Bayesian Estimation of Generalized Partition of Unity Copulas.“ Dependence Modeling 8: 119–131.
Brunk, Jens, Stottmeister, Johannes, Weinzierl, Sven, Matzner, Martin, und Becker, Jörg. 2020. „Exploring the Effect of Context Information on Deep Learning Business Process Predictions.“ Journal of Decision Systems 29 (sup1): 328–343. doi: 10.1080/12460125.2020.1790183.
Armbruster, L, Linster, E, Boyer, J, Brünje, A, Eirich, J, Stephan, I, Bienvenut, WV, Weidenhausen, J, Meinnel, T, Hell, R, Sinning, I, Finkemeier, I, Giglione, C, und Wirtz, M. 2020. „NAA50 is an enzymatically active Nα-acetyltransferase that is crucial for development and regulation of stress responses.“ Plant Physiology 183 (4): 1502–1516. doi: 10.1104/pp.20.00222.
Schneider, Florian, und Leibner, Tobias. 2020. „First-order continuous- and discontinuous-Galerkin moment models for a linear kinetic equation: Model derivation and realizability theory.“ Journal of Computational Physics 416: 109547.. doi: 10.1016/j.jcp.2020.109547.
Wallauer, R, Marauhn, P, Reimann, J, Zoerb, S, Kraus, F, Guedde, J, Rohlfing, M, und Hoefer, U. 2020. „Momentum-resolved observation of ultrafast interlayer charge transfer between the topmost layers of MoS2.“ Physical Review B 102 (12). doi: 10.1103/PhysRevB.102.125417.
Haags, A, Reichmann, A, Fan, Q, Egger, L, Kirschner, H, Naumann, T, Werner, S, Vollgraff, T, Sundermeyer, J, Eschmann, L, Yang, X, Brandstetter, D, Bocquet, FC, Koller, G, Gottwald, A, Richter, M, Ramsey, MG, Rohlfing, M, Puschnig, P, Gottfried, JM, Soubatch, S, und Tautz, FS. 2020. „Kekulene: On-Surface Synthesis, Orbital Structure, and Aromatic Stabilization.“ ACS Nano 14 (11): 15766–15775. doi: 10.1021/acsnano.0c06798.
Holtkemper, M, Quinteiro, GF, Reiter, DE, und Kuhn, T. 2020. „Selection rules for the excitation of quantum dots by spatially structured light beams: Application to the reconstruction of higher excited exciton wave functions.“ Physical Review B 102: 165315. doi: 10.1103/PhysRevB.102.165315.
Wrede, Fabian, und Kuchen, Herbert. 2020. „Towards High-Performance Code Generation for Multi-GPU Clusters Based on a Domain-Specific Language for Algorithmic Skeletons.“ International Journal of Parallel Programming 48 (4): 713–728. doi: 10.1007/s10766-020-00659-x.
Krukar, J, Mavros, P, und Hoelscher, C. 2020. „Towards capturing focal/ambient attention during dynamic wayfinding.“ Beitrag präsentiert auf der ETRA '20 Adjunct: ACM Symposium on Eye Tracking Research and Applications, Stuttgart doi: 10.1145/3379157.3391417.
Kholod, I, Rukavitsyn, A, Paznikov, A, und Gorlatch, S. 2020. „Parallelization of the self-organized maps algorithm for federated learning on distributed sources.“ The Journal of Supercomputing 2020. doi: 10.1007/s11227-020-03509-2.
Eickhoff, F, Kolodzeiski, E, Esat, T, Fournier, N, Wagner, C, Deilmann, T, Temirov, R, Rohlfing, M, Tautz, FS, und Anders, FB. 2020. „Inelastic electron tunneling spectroscopy for probing strongly correlated many body systems by scanning tunneling microscopy.“ Physical Review B 101 (12). doi: 10.1103/PhysRevB.101.125405.
Jeggle, Julian, Stenhammar, Joakim, und Wittkowski, Raphael. 2020. „Pair-distribution function of active Brownian spheres in two spatial dimensions: simulation results and analytic representation.“ Journal of Chemical Physics 152 (19): 194903.. doi: 10.1063/1.5140725.
Paas, B, Zimmermann, T, und Klemm, O. 2020. „Analysis of a turbulent wind field in a street canyon: Good agreement between LES model results and data from a mobile platform.“ Meteorologische Zeitschrift (Contrib. Atm. Sci.) 2020. doi: 10.1127/metz/2020/1006.
Doronin, O, Dergun, K, Dergachev, A, Ilina, A, und Gorlatch, S. 2020. „Testing of multithreaded applications with locks on non-atomic variables.“ Scientiﬁc and Technical Journal of Information Technologies, Mechanics and Optics 20 (2): 243–248. doi: 10.17586/2226-1494-2020-20-2-243-248.
Schroeder, C, Siozios, V, Mück-Lichtenfeld, C, Hunger, M, Hansen, MR, und Koller, H. 2020. „Hydrogen Bond Formation of Brønsted Acid Sites in Zeolites.“ Chemistry of Materials 32: 1564–1574. doi: 10.1021/acs.chemmater.9b04714.
Kucher, Vladyslav, Hunloh, Jens, und Gorlatch, Sergei. 2020. „Performance Portability and Unified Profiling for Finite Element Methods on Parallel Systems.“ Advances in Science, Technology and Engineering Systems Journal (ASTESJ) 5 (1): 119–127. doi: 10.25046/aj050116.
Bastian, P, Altenbernd, M, Dreier, N, Engwer, C, Fahlke, J, Fritze, R, Geveler, M, Göddeke, D, Iliev, O, Ippisch, O, Mohring, J, Müthing, S, Ohlberger, M, Ribbrock, D, Shegunov, N, und Turek, S. 2020. „Exa-Dune -- Flexible PDE Solvers, Numerical Methods and Applications.“ In Software for Exascale Computing - SPPEXA 2016-2019, Bd. 136 aus LNCSE, herausgegeben von Hans-Joachim Bungartz, Severin. Uekermann Benjamin Reiz, Philipp Neumann und Wolfgang E Nagel. Cham: Springer International Publishing. doi: 10.1007/978-3-030-47956-5_9.
Wrede, Fabian, Rieger, Christoph, und Kuchen, Herbert. 2020. „Generation of high-performance code based on a domain-specific language for algorithmic skeletons.“ The Journal of Supercomputing 75: 1–19. doi: 10.1007/s11227-019-02825-6.
Abadeer, Mina, und Gorlatch, Sergei. 2020. „Simulating Infection Transmission: A Case Study of COVID-19.“ In Modelling and Simulation 2020, herausgegeben von Alexandre Nketsa, Claude Baron und Clément Foucher. Toulouse: EUROSIS-ETI.
Leistikow, S, Nahardani, A, Hoerr, V, und Linsen, L. 2020. „Interactive Visual Similarity Analysis of Measured and Simulated Multi-field Tubular Flow Ensembles.“ In 10th Eurographics Workshop on Visual Computing for Biology and Medicine, VCBM 2020, Tübingen, Germany, September 28 - October 1, 2020, herausgegeben von B Kozlíková, M Krone, NN Smit, K Nieselt und RG Raidou. Eurographics Association. doi: 10.2312/vcbm.20201180.
Olthaus, J, Schrinner, PP J, Reiter, DE, und Schuck, C. 2020. „Optimal photonic crystal cavities for coupling nanoemitters to photonic integrated circuits.“ Advanced Quantum Technologies 3 (2): 1900084.. doi: 10.1002/qute.201900084.
2019
Ivashchenko, Sergey, und Mutschler, Willi. 2019. „The effect of observables, functional specifications, model features and shocks on identification in linearized DSGE models.“ Economic Modelling 2019. doi: 10.1016/j.econmod.2019.09.039.
Sandmann, N, Bachmann, J, Hepp, A, Doltsinis, NL, und Müller, J. 2019. „Copper(II)-mediated base pairing involving the artificial nucleobase 3H-imidazo[4,5-f]quinolin-5-ol.“ Dalton Transactions 48: 10505–10515. doi: 10.1039/C9DT02043H.
Meyer, H, Schmidt, J, Detsch, F, und Nauss, T. 2019. „Hourly gridded air temperatures of South Africa derived from MSG SEVIRI.“ International Journal of Applied Earth Observation and Geoinformation 78: 261–267. doi: 10.1016/j.jag.2019.02.006.
Maas, C., und Hansen, U. 2019. „Dynamics of a terrestrial magma ocean under planetary rotation: A study in spherical geometry.“ Earth and Planetary Science Letters 513: 81–94. doi: 10.1016/j.epsl.2019.02.016.
de, Araujo Pessoa Luis Filipe, Hellingrath, Bernd, und Buarque, de Lima Neto Fernando. 2019. „Automatic Generation of Optimization Algorithms for Production Lot-Sizing Problems.“ Beitrag präsentiert auf der IEEE Congress on Evolutionary Computation, Wellington, New Zealand , herausgegeben von IEEE
Rosati, R., Lengers, F., Reiter, D.E., und Kuhn, T. 2019. „Effective detection of spatio-temporal carrier dynamics by carrier capture.“ J. Phys.: Condens. Matter 31: 28LT01.. doi: 10.1088/1361-648x/ab17a8.
Lengers, F., Rosati, R., Kuhn, T., und Reiter, D.E. 2019. „Spatiotemporal dynamics of Coulomb-correlated carriers in semiconductors.“ Physical Review B - Condensed Matter 99: 155306.. doi: 10.1103/PhysRevB.99.155306.
Arora, A, Deilmann, T, Reichenauer, T, Kern, J, Vasconcellos, SM, Rohlfing, M, und Bratschitsch, R. 2019. „Excited-State Trions in Monolayer WS2.“ Physical Review Letters 123 (16): 167401.. doi: 10.1103/PhysRevLett.123.167401.
Heitger, J., Joswig, F., und Kuberski, S. 2019. „Towards the determination of the charm quark mass on N_f=2+1 CLS ensembles.“ In Lattice 2019, Bd. PoS LATTICE2019 aus Proceedings of Science Proceedings of Science.
Schneider, Florian, und Leibner, Tobias. 2019. „First-order continuous- and discontinuous-Galerkin moment models for a linear kinetic equation: realizability-preserving splitting scheme and numerical analysis.“ arXiv 2019.
Rasch, A, Schulze, R, und Gorlatch, S. 2019. „Generating Portable High-Performance Code via Multi-Dimensional Homomorphisms.“ Beitrag präsentiert auf der 28th International Conference on Parallel Architectures and Compilation Techniques (PACT), Seattle WA
Buender, Hendrik, und Herbert, Kuchen. 2019. „Towards Multi-editor Support for Domain-Specific Languages Utilizing the Language Server Protocol.“ Beitrag präsentiert auf der 7th MODELSWARD 2019: Prague, Czech Republic: Revised Selected Papers, Prag, Czechische Republik
Guzey, V, und Klasen, M. 2019. „Inclusive dijet photoproduction in ultraperipheral heavy ion collisions at the CERN Large Hadron Collider in next-to-leading order QCD.“ Phys. Rev. C99 (6): 065202.. doi: 10.1103/PhysRevC.99.065202.
Guzey, V, und Klasen, M. 2019. „Inclusive and diffractive dijet photoproduction in UPCs at the LHC in NLO QCD.“ In 2019 European Physical Society Conference on High Energy Physics (EPS-HEP2019) Ghent, Belgium, July 10-17, 2019
Berns, F, Schmidt, K, Grass, A, und Beecks, C. 2019. „A New Approach for Efficient Structure Discovery in IoT.“ In 2019 IEEE International Conference on Big Data (Big Data) Wiley-IEEE Press. doi: 10.1109/BigData47090.2019.9006082.
Engelnkemper, S, und Thiele, U. 2019. „The collective behaviour of ensembles of condensing liquid drops on heterogeneous inclined substrates.“ Europhysics Letters 127: 54002.. doi: 10.1209/0295-5075/127/54002.
Abadeer, M, und Gorlatch, S. 2019. „Distributed Simulation of Crowds with Groups in CrowdSim.“ In 2019 IEEE/ACM 23rd International Symposium on Distributed Simulation and Real Time Applications (DS-RT), herausgegeben von IEEE Cosenza: Wiley-IEEE Press. doi: 10.1109/DS-RT47707.2019.8958690.
Börner, MC, und Neugebauer, J. 2019. „Optimizing bidentate N-heterocyclic carbene ligands for the modification of late transition metal surfaces – new insights through theory.“ Phys. Chem. Chem. Phys. -: –.. doi: 10.1039/C9CP03840J.
Klaasen, H, Liu, L, Gao, H, Viergutz, L, Held, PA, Knecht, T, Meng, X, Börner, MC, Barton, D, Amirjalayer, S, Neugebauer, J, Studer, A, und Fuchs, H. 2019. „Intermolecular coupling and intramolecular cyclization of aryl nitriles on Au(111).“ Chemical communications 55: 11611–11614. doi: 10.1039/C9CC03418H.
Eschmann, L, Sabitova, A, Temirov, R, Tautz, FS, Krueger, P, und Rohlfing, M. 2019. „Coverage-dependent anisotropy of the NTCDA/Ag(111) interface state dispersion.“ Physical Review B 100 (12). doi: 10.1103/PhysRevB.100.125155.
Arora, A, Deilmann, T, Reichenauer, T, Kern, J, Vasconcellos, SM, Rohlfing, M, und Bratschitsch, R. 2019. „Excited-State Trions in Monolayer WS2.“ Physical Review Letters 123 (16). doi: 10.1103/PhysRevLett.123.167401.
Menezes, Breno, Amorim, Hugo, Kuchen, Herbert, und Buarque, Fernando. 2019. „Parallelization Strategies for GPU-Based Ant Colony Optimization Solving the Traveling Salesman Problem.“ Beitrag präsentiert auf der 2019 IEEE Congress on Evolutionary Computation (CEC), Wellington, New Zealand doi: 10.1109/CEC.2019.8790073.
Gesenhues, J, Nabok, D, Rohlfing, M, und Draxl, C. 2019. „Analytical representation of dynamical quantities in GW from a matrix resolvent (vol 96, 245124, 2017).“ Physical Review B 99 (9). doi: 10.1103/PhysRevB.99.099905.
Lettmann, T, und Rohlfing, M. 2019. „Electronic Excitations of Polythiophene within Many-Body Perturbation Theory with and without the Tamm-Dancoff Approximation.“ Journal of Chemical Theory and Computation 15 (8): 4547–4554. doi: 10.1021/acs.jctc.9b00223.
Borisenko, A, und Gorlatch, S. 2019. „Optimizing a GPU-Parallelized Ant Colony Metaheuristic by Parameter Tuning.“ In Parallel Computing Technologies. PaCT 2019, Bd. 11657 aus Lecture Notes in Computer Science, herausgegeben von V Malyshkin. Cham: Springer. doi: 10.1007/978-3-030-25636-4_12.
de Divitiis, G.M., Fritzsch, P., Heitger, J., Köster, C.C., Kuberski, S., und Vladikas, A. 2019. „Non-perturbative determination of improvement coefficients b_m and b_A-b_P and normalisation factor Z_m*Z_P/Z_A with N_f=3 Wilson fermions.“ European Physical Journal C 79 (9): 797.
Ali, S, Bergner, G, Gerber, H, Montvay, I, Münster, G, Piemonte, S, und Scior, P. 2019. „Numerical results for the lightest bound states in N=1 supersymmetric SU(3) Yang-Mills theory.“ Physical Review Letters 122: 221601.
Ali, S, Bergner, G, Gerber, H, Kuberski, S, Montvay, I, Münster, G, Piemonte, S, und Scior, P. 2019. „Variational analysis of low-lying states in supersymmetric Yang-Mills theory.“ Journal of High Energy Physics (JHEP) 2019 (04): 250. doi: 10.1007/JHEP04(2019)150.
Rasch, Ari, Bigge, Julian, Wrodarczyk, Martin, Schulze, Richard, und Gorlatch, Sergei. 2019. „dOCAL: high-level distributed programming with OpenCL and CUDA.“ The Journal of Supercomputing 65: 1–22. doi: 10.1007/s11227-019-02829-2.
Fischer, J, Walter, C, Tönges, A, Aleth, H, Jordão, MJC, Leddin, M, Gröning, V, Erdmann, T, Lenz, G, Roth, J, Vogl, T, Prinz, M, Dugas, M, Jacobsen, ID, und Rosenbauer, F. 2019. „Safeguard function of PU.1 shapes the inflammatory epigenome of neutrophils.“ Nature Immunology Mar 25.
Guzey, V, und Klasen, M. 2019. „Constraints on nuclear parton distributions from dijet photoproduction at the LHC.“ Eur. Phys. J. C79: 396.
Rieger, Christoph, Wrede, Fabian, und Kuchen, Herbert. 2019. „Musket: A Domain-Specific Language for High-Level Parallel Programming with Algorithmic Skeletons.“ Beitrag präsentiert auf der 34nd Annual ACM Symposium on Applied Computing (SAC), Limassol, Cyprus doi: 10.1145/3297280.3297434.
Kucher, Vladyslav, Fey, Florian, und Gorlatch, Sergei. 2019. „Unified Cross-Platform Profiling of Parallel C++ Applications.“ Beitrag präsentiert auf der 2018 IEEE/ACM Performance Modeling, Benchmarking and Simulation of High Performance Computer Systems (PMBS), Dallas, TX, USA doi: 10.1109/PMBS.2018.8641652.
Rasch, A, und Gorlatch, S. 2019. „ATF: A generic directive‐based auto‐tuning framework.“ Concurrency Computation - Practice and Experience 31 (5). doi: 10.1002/cpe.4423.
Heissenbüttel, M, Marauhn, P, Deilmann, T, Krüger, P, und Rohlfing, M. 2019. „Nature of the excited states of layered systems and molecular excimers: Exciplex states and their dependence on structure.“ Physical Review B 99: 035425.. doi: 10.1103/PhysRevB.99.035425.
Kötter, A, Mootz, H, und Heuer, A. 2019. „Standard binding free energy of a SIM SUMO complex.“ J. Chem. Theory Comp. 15: 6403–6410.
Hakobyan, D, und Heuer, A. 2019. „Comparing an all-atom and a coarse-grained description of lipid bilayers in terms of enthalpies and entropies: from MD simulations to 2D lattice models.“ J. Chem.Theory Comp. 15: 6393–6402.
Raschke, S, und Heuer, A. 2019. „Non-equilibrium effects of micelle formation as studied by a minimum particle-based model.“ J. Chem. Phys. 150(20): 204903..
Roy, PK, und Heuer, A. 2019. „Ring statistics in 2D-silica: effective temperatures in equilibrium.“ Phys. Rev. Lett. 122: 016104..
2018
Ali, S, Bergner, G, Gerber, H, Giudice, P, Kuberski, S, Montvay, I, Münster, G, Piemonte, S, und Scior, P. 2018. „Improved results for the mass spectrum of N = 1 supersymmetric SU(3) Yang-Mills theory.“ In Proceedings of the 35th International Symposium on Lattice Field Theory (Lattice 2017), Bd. 175 aus EPJ Web of Conferences, herausgegeben von M. Della Morte, P. Fritzsch, E. Gámiz Sánchez und C. Pena Ruano. Les Ulis Cedex: EDP Sciences. doi: 10.1051/epjconf/201817508001.
Wrede, Fabian, Menezes, Breno, und Kuchen, Herbert. 2018. „Fish School Search with Algorithmic Skeletons.“ International Journal of Parallel Programming - (-): 1–19. doi: 10.1007/s10766-018-0564-z.
Menezes, Breno, Wrede, Fabian, Kuchen, Herbert, und Buarque, Fernando. 2018. „Parameter Selection for Swarm Intelligence Algorithms: Case Study on Parallel Implementation of FSS.“ Beitrag präsentiert auf der 4th IEEE Latin American Conference on Computational Intelligence (LA-CCI '17), Arequipa, Peru doi: 10.1109/LA-CCI.2017.8285694.
Harrison, MC, Arning, N, Kremer, LPM, Ylla, G, Belles, X, Bornberg-Bauer, E, Huylmans, AK, Jongepier, E, Piulachs, MD, Richards, S, und Schal, C. 2018. „Expansions of key protein families in the German cockroach highlight the molecular basis of its remarkable success as a global indoor pest.“ J. Exp. Zool. B Mol. Dev. Evol. 330 (5): 254–264. doi: 10.1002/jez.b.22824.
Wrede, Fabian, Menezes, Breno, Pessoa, Luis F., Hellingrath, Bernd, Buarque, Fernando, und Kuchen, Herbert. 2018. „High-level Parallel Implementation of Swarm Intelligence-based Optimization Algorithms with Algorithmic Skeletons.“ In Parallel Computing is Everywhere, Bd. 32 aus Advances In Parallel Computing, herausgegeben von Sanzio Bassini, Marco Danelutto, Patrizio Dazzi, Gerhard R. Joubert und Frans Peters. Amsterdam, Berlin, Washington DC: IOP Publishing.
Rasch, A, und Gorlatch, S. 2018. „ATF: A Generic, Directive-Based Auto-Tuning Framework.“ Concurrency Computation - Practice and Experience 30 (3). doi: 10.1002/cpe.4423.
Ali, S, Bergner, G, Gerber, H, Giudice, P, Kuberski, S, Montvay, I, Münster, G, Piemonte, S, und Scior, P. 2018. „Supermultiplets in N =1 SUSY SU(2) Yang-Mills theory.“ In Proceedings of the 35th International Symposium on Lattice Field Theory (Lattice 2017), Bd. 175 aus EPJ Web of Conferences
Ali, S, Bergner, G, Gerber, H, Giudice, P, Montvay, I, Münster, G, Piemonte, S, und Scior, P. 2018. „Ward identities in N = 1 supersymmetric SU(3) Yang-Mills theory on the lattice.“ In Proceedings of the 35th International Symposium on Lattice Field Theory (Lattice 2017), Bd. 175 aus EPJ Web of Conferences
Arora, A, Deilmann, T, Marauhn, P, Drüppel, M, Schneider, R, Molas, MR, Vaclavkova, D, Michaelis, de Vasconcellos S, Rohlfing, M, Potemski, M, und and, Bratschitsch R. 2018. „Valley-contrasting optics of interlayer excitons in Mo- and W-based bulk transition metal dichalcogenides.“ Nanoscale 10: 15571–15577. doi: 10.1039/C8NR03764G.
Mönig, H., Amirjalayer, S., Timmer, A., Hu, Z.-X., Liu, L., Díaz Arado, O., Cnudde, M., Strassert, C.A., Ji, W., Rohlfing, M., und Fuchs, H. 2018. „Quantitative assessment of intermolecular interactions by atomic force microscopy imaging using copper oxide tips.“ Nature Nanotechnology 13 (5): 371–375. doi: 10.1038/s41565-018-0104-4.
Kholod, I, Shorov, A, Titkov, E, und Gorlatch, S. 2018. „A formally based parallelization of data mining algorithms for multi-core systems.“ The Journal of Supercomputing 2018: 1–12. doi: 10.1007/s11227-018-2473-8.
Borisenko, A, und Gorlatch, S. 2018. „Comparing GPU-parallelized metaheuristics to branch-and-bound for batch plants optimization.“ The Journal of Supercomputing 2018: 1–13. doi: 10.1007/s11227-018-2472-9.
Bergner, G, Giudice, P, Montvay, I, Münster, G, Piemonte, S, und Scior, P. 2018. „Low energy properties of SU(2) gauge theory with N_f = 3/2 flavours of adjoint fermions.“ Journal of High Energy Physics (JHEP) 2018 (1): 119.
Ali, S, Bergner, G, Gerber, H, Giudice, P, Montvay, I, Münster, G, Piemonte, S, und Scior, P. 2018. „Investigation of theories beyond the standard model.“ In Proceedings of the NIC Symposium 2018, Bd. 49 aus NIC Series, herausgegeben von K Binder, M Müller und A Trautmann. Jülich.
Brunk, Jens, Riehle, Dennis M, und Delfmann, Patrick. 2018. „Prediction of Customer Movements in Large Tourism Industries by the Means of Process Mining.“ Beitrag präsentiert auf der European Conference on Information Systems (ECIS 2018), Portsmouth, UK
Lange, M., Tendyck, J., Wegener, P., Hepp, A., Würthwein, E., und Uhl, W. 2018. „Reactions of an Aluminium/Phosphorus Frustrated Lewis Pair (FLP) with α,β-Unsaturated Carbonyl Compounds: FLPs as Efficient Two-Electron Reductants with the Formation of Enolates, a cis-Enediolate, and an Allene.“ Chemistry - A European Journal null (null). doi: 10.1002/chem.201706089.
Niehues, I, Schmidt, R, Drüppel, M, Marauhn, P, Christiansen, D, Selig, M, Berghäuser, G, Wigger, D, Schneider, R, Braasch, L, Koch, R, Castellanos-Gomez, A, Kuhn, T, Knorr, A, Malic, E, Rohlfing, M, Michaelis, de Vasconcellos S, und and, Bratschitsch R. 2018. „Strain control of exciton-phonon coupling in atomically thin semiconductors.“ Nano Letters 18 (3): 1751–1757. doi: 10.1021/acs.nanolett.7b04868.
Hagedorn, B, Stoltzfus, L, Steuwer, M, Gorlatch, S, und Dubach, C. 2018. „High Performance Stencil Code Generation with Lift.“ In Proceedings of the 2018 International Symposium on Code Generation and Optimization, {CGO} 2018, Vössendorf / Vienna, Austria, February 24-28, 2018 doi: 10.1145/3168824.
Hagedorn, B., Steuwer, M., und Gorlatch, S. 2018. „A Transformation-Based Approach to Developing High-Performance GPU Programs.“ In Bd. null aus Lecture Notes in Computer Science (including subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics) Springer. doi: 10.1007/978-3-319-74313-4_14.
Menezes, Breno, Wrede, Fabian, Kuchen, Herbert, und Buarque, Fernando. 2018. „Parameter Selection for Swarm Intelligence Algorithms: Case Study on Parallel Implementation of FSS.“ International Journal of Swarm Intelligence Research, Volume 9 9. doi: 10.4018/IJSIR.2018100101.
Harrison, MC, Jongepier, E, Robertson, HM, Arning, N, Bitard-Feildel, T, Chao, H, Childers, CP, Dinh, H, Doddapaneni, H, Dugan, S, Gowin, J, Greiner, C, Han, Y, Hu, H, Hughes, DST, Huylmans, A, Kemena, C, Kremer, LPM, Lee, SL, Lopez-Ezquerra, A, Mallet, L, Monroy-Kuhn, JM, Moser, A, Murali, SC, Muzny, DM, Otani, S, Piulachs, M, Poelchau, M, Qu, J, Schaub, F, Wada-Katsumata, A, Worley, KC, Xie, Q, Ylla, G, Poulsen, M, Gibbs, RA, Schal, C, Richards, S, Belles, X, Korb, J, und Bornberg-Bauer, E. 2018. „Hemimetabolous genomes reveal molecular basis of termite eusociality.“ Nature Ecology and Evolution 2 (3): 557–566. doi: 10.1038/s41559-017-0459-1DO-10.1038/s41559-017-0459-1.
Guzey, V, und Klasen, M. 2018. „Inclusive dijet photoproduction in ultraperipheral heavy-ion collisions at the LHC in next-to-leading order QCD.“ Phys. Rev. C99: 065202.
Fritzsch, P., Heitger, J., und Kuberski, S. 2018. „O(a) improved quark mass renormalization for a non-perturbative matching of HQET to three-flavor QCD.“ In Lattice 2018, Bd. PoS LATTICE2018 aus Proceedings of Science Proceedings of Science.
Heitger, J., Joswig, F., und Vladikas, A. 2018. „Z_S/Z_P from three-flavour lattice QCD.“ In Lattice 2018, Bd. PoS LATTICE2018 aus Proceedings of Science Proceedings of Science.
Collins, S., Eckert, K., Heitger, J., Hofmann, S., und Söldner, W. 2018. „Leptonic decay constants for D-mesons from 3-flavour CLS ensembles.“ In Lattice 2017, Bd. 175 (2018) aus EPJ Web Conf. Springer.
Heitger, J., Joswig, F., Vladikas, A., und Wittemeier, C. 2018. „Non-perturbative determination of c_V, Z_V and Z_S/Z_P in N_f=3 lattice QCD.“ In Lattice 2017, Bd. 175 (2018) aus EPJ Web Conf. Springer.
de Divitiis, G.M., Firrotta, M., Heitger, J., Köster, C., und Vladikas, A. 2018. „Non-perturbative determination of improvement b-coefficients in N_f=3.“ In Lattice 2017, Bd. 175 (2018) aus EPJ Web Conf. Springer.
Bergner, G, Giudice, P, Montvay, I, Münster, G, Piemonte, S, und Scior, P. 2018. „Indications for infrared conformal behaviour of SU(2) gauge theory with Nf = 3/2 flavours of adjoint fermions.“ In Proceedings of the 36th International Symposium on Lattice Field Theory (Lattice 2018), Bd. PoS(LATTICE2018) aus Proceedings of Science Proceedings of Science.
Ali, S, Bergner, G, Gerber, H, Lopez, C, Montvay, I, Münster, G, Piemonte, S, und Scior, P. 2018. „Baryonic states in supersymmetric Yang-Mills theory.“ In Proceedings of the 36th International Symposium on Lattice Field Theory (Lattice 2018), Bd. PoS(LATTICE2018) aus Proceedings of Science Proceedings of Science.
Ali, S, Bergner, G, Gerber, H, Montvay, I, Münster, G, Piemonte, S, und Scior, P. 2018. „Analysis of Ward identities in supersymmetric Yang-Mills theory.“ European Physical Journal C: Particles and Fields 78 (5): 404. doi: 10.1140/epjc/s10052-018-5887-9.
Ali, S, Bergner, G, Gerber, H, Giudice, P, Montvay, I, Münster, G, Piemonte, S, und Scior, P. 2018. „The light bound states of N=1 supersymmetric SU(3) Yang-Mills theory on the lattice.“ Journal of High Energy Physics (JHEP) 2018 (03): 113. doi: 10.1007/JHEP03(2018)113.
Brunk, Jens, Revoredo, Kate, Stierle, Matthias, Matzner, Martin, Delfmann, Patrick, und Becker, Jörg. 2018. „Prediction of Business Process Instances with Dynamic Bayesian Networks.“ In Proceedings of the 8th International Symposium on Data-driven Process Discovery and Analysis (SIMPDA 2018), Bd. 2270 , herausgegeben von Paolo Ceravolo, López M. Teresa Gómez und Keulen Maurice Van. Sevilla, Spanien: CEUR-WS.
Chen, T, Hao, Y, Jin, F, Wei, M, Feng, J, Jia, R, Yi, Z, Rohlfing, M, Liu, C, und Ma, Y. 2018. „Origin of the deep band-gap state in TiO2(110): dd-sigma bonds between Ti-Ti pairs.“ Phys. Rev. B 98: 205135.. doi: 10.1103/PhysRevB.98.205135.
Temirov, R, Green, MFB, Friedrich, N, Leinen, P, Esat, T, Chmielniak, P, Sarwar, S, Rawson, J, Koegerler, P, Wagner, C, Rohlfing, M, und Tautz, FS. 2018. „Molecular Model of a Quantum Dot Beyond the Constant Interaction Approximation.“ Physical Review Letters 120 (20). doi: 10.1103/PhysRevLett.120.206801.
Niu, Y, Gonzalez-Abad, S, Frisenda, R, Marauhn, P, Drueppel, M, Gant, P, Schmidt, R, Taghavi, NS, Barcons, D, Molina-Mendoza, AJ, Vasconcellos, SM, Bratschitsch, R, Perez, DeLara D, Rohlfing, M, und Castellanos-Gomez, A. 2018. „Thickness-Dependent Differential Reflectance Spectra of Monolayer and Few-Layer MoS2, MoSe2, WS2 and WSe2.“ Nanomaterials 8 (9). doi: 10.3390/nano8090725.
Drueppel, M, Deilmann, T, Noky, J, Marauhn, P, Krueger, P, und Rohlfing, M. 2018. „Electronic excitations in transition metal dichalcogenide monolayers from an LDA plus GdW approach.“ Physical Review B 98 (15). doi: 10.1103/PhysRevB.98.155433.
Eickholt, P, Noky, J, Schwier, EF, Shimada, K, Miyamoto, K, Okuda, T, Datzer, C, Drueppel, M, Krueger, P, Rohlfing, M, und Donath, M. 2018. „Location of the valence band maximum in the band structure of anisotropic 1T '-ReSe2.“ Physical Review B 97 (16). doi: 10.1103/PhysRevB.97.165130.
Kerber, R, Fitzgerald, J, Xiao, X, Oh, S, Maier, S, Giannini, V, und Reiter, D. 2018. „Interaction of an Archimedean spiral structure with orbital angular momentum light.“ New Journal of Physics 20 (9): 095005.. doi: 10.1088/1367-2630/aae105.
Narayanan, Kishnamoorthy A, Oldiges, K, Winter, M, Heuer, A, Cekic-Laskovic, I, Holm, C, und Smiatek, J. 2018. „Electrolyte solvents for high voltage lithium ion batteries: ion correlation and specific anion effects in adiponitrile.“ Phys.Chem.Chem.Phy., 25701. doi: 10.1002/aenm.201802151.
Wrede, Fabian, Rieger, Christoph, und Kuchen, Herbert. 2018. „Generation of High-Performance Code Based on a Domain-Specific Language for Algorithmic Skeletons.“ Beitrag präsentiert auf der High-Level Parallel Programming and Applications (HLPP '18), Orléans, France
Smiatek, J, Heuer, A, und Winter, M. 2018. „Properties of Ion Complexes and Their Impact on Charge Transport in Organic Solvent-Based Electrolyte Solutions for Lithium Batteries: Insights from a Theoretical Perspective.“ Batteries 4/4): 62..
Himpe, C, Leibner, T, und Rave, S. 2018. „Hierarchical Approximate Proper Orthogonal Decomposition.“ SIAM Journal on Scientific Computing 40 (5): A3267–A3292.
Wrede, Fabian, und Ernsting, Steffen. 2018. „Simultaneous CPU–GPU Execution of Data Parallel Algorithmic Skeletons.“ International Journal of Parallel Programming 46 (1): 42–61. doi: 10.1007/s10766-016-0483-9.
2017
Wrede, Fabian, und von, Hof Vincent. 2017. „Enabling Efficient Use of Algorithmic Skeletons in Cloud Environments: Container-based Virtualization for Hybrid CPU-GPU Execution of Data-parallel Skeletons.“ In SAC '17 Proceedings of the Symposium on Applied Computing, herausgegeben von Sung Y. Shin, Dongwan Shin und Maria Lencastre. New York, NY, USA: ACM Press. doi: 10.1145/3019612.3019894.
Haidl, M, Steuwer, M, Dirks, H, Humernbrum, T, und Gorlatch, S. 2017. „Towards Composable GPU Programming: Programming GPUs with Eager Actions and Lazy Views.“ In Proceedings of the 8th International Workshop on Programming Models and Applications for Multicores and Manycores, herausgegeben von Q Chen und Z Huang. New York, NY: ACM Press. doi: 10.1145/3026937.3026942.
Bohl, MT, Branger, N, und Trede, M. 2017. „The Case for Herding is Stronger than You Think.“ Journal of Banking and Finance 85 (December): 30–40. doi: 10.1016/j.jbankfin.2017.08.006.
Arora, A, Noky, J, Drüppel, M, Jariwala, B, Deilmann, T, Schneider, R, Schmidt, R, Del, Pozo-Zamudio O, Stiehm, T, Bhattacharya, A, Krüger, P, Michaelis, de Vasconcellos S, Rohlfing, M, und Bratschitsch, R. 2017. „Highly Anisotropic in-Plane Excitons in Atomically Thin and Bulklike 1T′-ReSe2.“ Nano Letters 17 (5): 3202–3207. doi: 10.1021/acs.nanolett.7b00765.
Byrne, PA, Kobayashi, S, Würthwein, EU, Ammer, J, und Mayr, H. 2017. „Why are Vinyl Cations Sluggish Electrophiles?“ J. Amer. Chem. Soc. 139: 1499–1511.
Wilczek, M., Tewes, W., Engelnkemper, S., Gurevich, S.V., und Thiele, U. 2017. „Sliding Drops: Ensemble Statistics from Single Drop Bifurcations.“ Physical Review Letters 119: 204501.. doi: 10.1103/PhysRevLett.119.204501.
Rasch, A, und Gorlatch, S. 2017. „Multi-Dimensional Homomorphisms and Their Implementation in OpenCL.“ International Journal of Parallel Programming 2017: 1–19. doi: 10.1007/s10766-017-0508-z.
Frisenda, R, Drüppel, M, Schmidt, R, Michaelis, de Vasconcellos S, Perez, de Lara D, Bratschitsch, R, Rohlfing, M, und and, Castellanos-Gomez A. 2017. „Biaxial strain tuning of the optical properties of single-layer transition metal dichalcogenides.“ npj 2D Materials and Applications 1. doi: 10.1038/s41699-017-0013-7.
Trinschek, S, John, K, Lecuyer, S, und Thiele, U. 2017. „Continuous vs. arrested spreading of biofilms at solid-gas interfaces - the role of surface forces.“ Phys. Rev. Lett. 119: 078003..
Datzer, C., Zumbülte, A., Braun, J., Förster, T., Schmidt, A., Mi, J., Iversen, B., Hofmann, P., Minár, J., Ebert, H., Krüger, P., Rohlfing, M., und Donath, M. 2017. „Unraveling the spin structure of unoccupied states in Bi2Se3.“ Physical Review B 95 (11). doi: 10.1103/PhysRevB.95.115401.
Collins, S., Eckert, K., Heitger, J., Hofmann, S., und Söldner, W. 2017. „Charmed pseudoscalar decay constants on three-flavour CLS ensembles with open boundaries.“ In LATTICE2016, Bd. LATTICE2016 aus Proceedings of Science Proceedings of Science.
Della, Morte M., Heitger, J., Korcyl, P., Simma, H., und Wittemeier, C. 2017. „Non-perturbative matching of HQET heavy-light axial and vector currents in N_f=2 lattice QCD.“ In LATTICE2016, Bd. LATTICE2016 aus Proceedings of Science Proceedings of Science.
Haidl, M, und Gorlatch, S. 2017. „High-Level Programming for Many-Cores using C++14 and the STL.“ International Journal of Parallel Programming 2017. doi: 10.1007/s10766-017-0497-y.
Wilczek, M., Zhu, J., Chi, L., Thiele, U., und Gurevich, S.V. 2017. „Dip-coating with prestructured substrates: transfer of simple liquids and Langmuir-Blodgett monolayers.“ J. Phys.: Condens. Matter 29: 014002.. doi: 10.1088/0953-8984/29/1/014002.
Bergner, G, Giudice, P, Montvay, I, Münster, G, und Piemonte, S. 2017. „The spectrum and mass anomalous dimension of SU(2) adjoint QCD with two Dirac flavours.“ Physical Review D - Particles, Fields, Gravitation, and Cosmology 96: 034504. doi: 10.1103/PhysRevD.96.034504.
Xu, P, Würthwein, E-U, Daniliuc, C-G, und Studer, A. 2017. „Übergangsmetallfreie ringöffnende Silylierung von Indolen undBenzofuranen mit (Diphenyl-tert-butylsilyl)lithium.“ Angew. Chem. 2017: 14060–14063.
Hokamp, T, Dewanji, A, Lübbesmeyer, M, Mück-Lichtenfeld, C, Würthwein, E-U, und Studer, A. 2017. „Radical Hydrodehalogenation of Aryl Bromides and Chlorides with Sodium Hydride and 1,4-Dioxane.“ Angew. Chem. Int. Edition 2017: 13275–13278.
Hokamp, T, Dewanji, A, Lübbesmeyer, M, Mück-Lichtenfeld, C, Würthwein, E.-U., und Studer, A. 2017. „Radikalische Hydrodehalogenierung von Arylbromiden und –chloriden mit Natriumhydrid und 1,4-Dioxan.“ Angew. Chem. 2017: 13459–13462.
Drüppel, M., Deilmann, T., Krüger, P., und Rohlfing, M. 2017. „Diversity of trion states and substrate effects in the optical properties of an MoS2 monolayer.“ Nature Communications 8 (1). doi: 10.1038/s41467-017-02286-6.
Kessler, Christoph, Gorlatch, Sergei, Enmyren, Johan, Dastgeer, Usman, Steuwer, Michel, und Kegel, Philipp. 2017. „Skeleton Programming for Portable Many-Core Computing.“ In Programming Multicore and Many-core Computing Systems, herausgegeben von Sabri Pllana und Fatos Xhafa. John Wiley & Sons.
Würthwein, G, Lanvers-Kaminsky, C, Hempel, G, Gastine, S, Möricke, A, Schrappe, M, Karlsson, M, und Boos, J. 2017. „Population Pharmacokinetics to Model the Time-Varying Clearance of the PEGylated Asparaginase Oncaspar® in Children with Acute Lymphoblastic Leukemia.“ European Journal of Drug Metabolism and Pharmacokinetics 42 (6): 955–963. doi: 10.1007/s13318-017-0410-5.
Martinewski, K., Holtrichter-Rößmann, T., Rösener, C., Hepp, A., Würthwein, E., und Uhl, W. 2017. „Cooperative Activation of Isocyanates by Al–N-Based Active Lewis Pairs and the Generation of a C5 Chain by Simultaneous Formation of Two C–C Bonds.“ Chemistry - A European Journal 23 (25): 6129–6141. doi: 10.1002/chem.201604630.
Hakobyan, D, Gerke, V, und Heuer, A. 2017. „Modeling of annexin A2ÐMembrane interactions by molecular dynamics simulations.“ PloS one 12(9): e0185440..
Diddens, D, Lesch, V, Heuer, A, und Smiatek, J. 2017. „Aqueous Ionic Liquids and Their Influence on Peptide Conformations: Denaturation and Dehydration Mechanisms.“ Phys. Chem. Chem. Phys. 19: 20430–20440.
de Jong, DH, und Heuer, A. 2017. „The influence of solid scaffolds on flat and curved lipid membranes.“ AIP Advances 7: 075007..
Diddens, D, Paillard, E, und Heuer, A. 2017. „Improving the Lithium Ion Transport in Polymer Electrolytes by Functionalized Ionic-Liquid Additives: Simulations and Modeling.“ J.Electrochem. Soc., 164 (11): E3225–E3231..
Marek, JJ, Singh, RP, Heuer, A, und Hennecke, U. 2017. „Enantioselective Catalysis by Using Short, Structurally Defined DNA Hairpins as Scaffold for Hybrid Catalysts.“ Chem. Eur. J. 23: 6004–6008.
Danielova, Zaharieva Martina, Trede, Mark, und Wilfling, Bernd. 2017. „Bayesian semiparameric multivariate stochastic volatility with an application to international volatility co-movements.“ CQE-Working-Papers Nr. 62/2017. University of Muenster: Center for Quantitative Economics (CQE), University of Muenster.
Deilmann, T., und Rohlfing, M. 2017. „Huge Trionic Effects in Graphene Nanoribbons.“ Nano Letters 17 (11): 6833–6837. doi: 10.1021/acs.nanolett.7b03111.
Borisenko, A, und Gorlatch, S. 2017. „Parallelizing Metaheuristics for Optimal Design of Multiproduct Batch Plants on GPU.“ In Lecture Notes in Computer Science (LNCS, volume 10421), herausgegeben von V. Malyshkin. Cham: Springer. doi: 10.1007/978-3-319-62932-2_39.
Riemenschneider, M, Herbst, A, Rasch, A, Gorlatch, S, und Heider, D. 2017. „eccCL: Parallelized GPU Implementation of Ensemble Classifier Chains.“ BMC Bioinformatics 2017. doi: 10.1186/s12859-017-1783-9.
2016
Förster, Tobias, Krüger, Peter, und Rohlfing, Michael. 2016. „GW calculations for Bi2Te3 and Sb2Te3 thin films: Electronic and topological properties.“ Physical Review B - Condensed Matter 93 (20): 205442.. doi: 10.1103/PhysRevB.93.205442.
Deilmann, T, Drüppel, M, und Rohlfing, M. 2016. „Three-particle correlation from a Many-Body Perspective: Trions in a Carbon Nanotube.“ Physical Review Letters 116 (19): 196804. doi: 10.1103/PhysRevLett.116.196804.
Boecker, F, Buerger, H, Mallela, NV, und Korsching, E. 2016. „TMAinspiration: Decode Interdependencies in Multifactorial Tissue Microarray Data.“ Cancer Informatics 15: 143–149. doi: 10.4137/CIN.S39112.
Fritzsch, P., Garron, N., und Heitger, J. 2016. „Non-perturbative tests of continuum HQET through small-volume two-flavour QCD.“ Journal of High Energy Physics (JHEP) 2016 (1): 1–44. doi: 10.1007/JHEP01(2016)093.
Bulava, J., Della, Morte M., Heitger, J., und Wittemeier, C. 2016. „Nonperturbative renormalization of the axial current in N f=3 lattice QCD with Wilson fermions and a tree-level improved gauge action.“ Physical Review D - Particles, Fields, Gravitation, and Cosmology 93 (11): 114513. doi: 10.1103/PhysRevD.93.114513.
Schulte, A, Janich, S, Würthwein, E.-U, Saito, S, und Wünsch, B. 2016. „Investigation of the Corey Bromolactamization with N-Functionalized Allylamines.“ J. Heterocycl. Chem. 53: 1827–1837.
Keweloh, L, Klöcker, H, Würthwein, E.-U, und Uhl, W. 2016. „Ein P-H-funktionalisiertes Al/P-basiertes frustriertes Lewis-Paar: Substrataktivierung und selektiver Wasserstofftransfer.“ Angew. Chem. 128: 3266–3269.
Wrobel, AJ, Lucchesi, R, Wibbeling, B, Daniliuc, C-G, Fröhlich, R, und Würthwein, E-U. 2016. „1,3,5-Triazapenta¬dienes by Nucleophilic Addition to 1,3- and 1,4- Dinitriles: Sterically Constrained Examples by Incorporation into Cyclic Peripheries: Synthesis, Aggregation, and Photophysical Properties.“ J. Org. Chem. 81: 2849–2863.
Holtrichter-Rößmann, T, Häger, I, Daniliuc, C.-G., Fröhlich, R, Bergander, K, Troll, C, Rieger, B, Rojas, R.S., und Würthwein, E.-U. 2016. „Catalytically Active N-Acylamidine – Zirconium Complexes: Synthesis, Structures and Application in Ethylene Polymerization.“ Organometallics 35: 1906–1915.
Bergner, G, Giudice, P, Montvay, I, Münster, G, und Piemonte, S. 2016. „The strong interactions beyond the standard model of particle physics.“ In High Performance Computing in Science and Engineering, herausgegeben von S Wagner, A Bode, H Brüchle und M Brehm. München: Bayerische Akademie der Wissenschaften.
Bergner, G, Giudice, P, Montvay, I, Münster, G, und Piemonte, S. 2016. „Spectrum and mass anomalous dimension of SU(2) gauge theories with fermions in the adjoint representation: from Nf=1/2 to Nf=2.“ In Proceedings of the 34th International Symposium on Lattice Field Theory (Lattice 2016), PoS(LATTICE2016)
Ali, S, Bergner, G, Gerber, H, Giudice, P, Montvay, I, Münster, G, und Piemonte, S. 2016. „Simulations of N=1 supersymmetric Yang-Mills theory with three colours.“ In Proceedings of the 34th International Symposium on Lattice Field Theory (Lattice 2016), PoS(LATTICE2016)
Guzey, V., und Klasen, M. 2016. „Diffractive dijet photoproduction in ultraperipheral collisions at the LHC in next-to-leading order QCD.“ Journal of High Energy Physics (JHEP) 2016 (4). doi: 10.1007/JHEP04(2016)158.
Guzey, V., und Klasen, M. 2016. „A fresh look at factorization breaking in diffractive photoproduction of dijets at HERA at next-to-leading order QCD.“ European Physical Journal C: Particles and Fields 76 (8). doi: 10.1140/epjc/s10052-016-4304-5.
Esat, T., Lechtenberg, B., Deilmann, T., Wagner, C., Krüger, P., Temirov, R., Rohlfing, M., Anders, F., und Tautz, F. 2016. „A chemically driven quantum phase transition in a two-molecule Kondo system.“ Nature Physics 12 (9): 867–873. doi: 10.1038/nphys3737.
Uhl, W., Wegener, P., Layh, M., Hepp, A., und Würthwein, E. 2016. „Reaction of an Al/P-based frustrated Lewis pair with benzophenone: Formation of adducts and aluminium alcoholates via ß-hydride elimination.“ Zeitschrift für Naturforschung B - A Journal of Chemical Sciences 71 (10): 1043–1050. doi: 10.1515/znb-2016-0118.
Milk, R, Rave, S, und Schindler, F. 2016. „pyMOR - Generic algorithms and interfaces for model order reduction.“ SIAM Journal on Scientific Computing 38 (5): S194–S216. doi: 10.1137/15M1026614.
Borisenko, A, Haidl, M, und Gorlatch, S. 2016. „A GPU parallelization of branch-and-bound for multiproduct batch plants optimization.“ The Journal of Supercomputing 72: 1–13. doi: 10.1007/s11227-016-1784-x.
Lesch, V, Heuer, A, Holm, C, und Smiatek, J. 2016. „Properties of Apolar Solutes in Alkyl-Imidazolium Based Ionic Liquids: The Crucial Importance of Local Interactions.“ ChemPhysChem 2016: 387–394.
Lesch, V, Li, Z, Bedrov, D, Borodin, O, und Heuer, A. 2016. „Influence of cation on lithium ion coordination and transport in ionic liquid electrolytes: A molecular dynamics simulation study.“ Phys. Chem. Chem. Phys. 2016: 382–392.
Lesch, V, Heuer, A, Rad, BR, Winter, M, und Smiatek, J. 2016. „Atomistic insights into deep eutectic electrolytes: the influence of urea on the electrolyte salt LiTFSI in view of electrochemical applications.“ Physical Chemistry Chemical Physics 41: 28403–28408. doi: 10.1039/C6CP04217A.
Uhl, W., Honacker, C., Hepp, A., Layh, M., und Würthwein, E. 2016. „σ-Bond Activation in Aluminium-Functionalized Alkynylchlorogermanes: Facile Insertion of Isocyanate and Azide into Al–C and Ge–Cl Bonds.“ European Journal of Inorganic Chemistry 2016 (26): 4170–4178. doi: 10.1002/ejic.201600764.
Green, MFB, Wagner, C, Leinen, P, Deilmann, T, Krüger, P, Rohlfing, M, Tautz, FS, und Temirov, R. 2016. „Scanning quantum dot microscopy: A quantitative method to measure local electrostatic potential near surfaces.“ Japanese Journal of Applied Physics 55 (8S1): 08NA04.. doi: 10.7567/JJAP.55.08NA04.
Bergner, G, Giudice, P, Montvay, I, Münster, G, und Piemonte, S. 2016. „The light bound states of supersymmetric SU(2) Yang-Mills theory.“ Journal of High Energy Physics (JHEP) 2016 (03): 080. doi: 10.1007/JHEP03(2016)080.
Haidl, M, Hagedorn, B, und Gorlatch, S. 2016. „Programming GPUs with C++14 and Just-In-Time Compilation.“ In Bd. 27 aus Advances in Parallel Computing Amsterdam, Netherlands: IOP Publishing. doi: 10.3233/978-1-61499-621-7-247.
Haidl, M, Steuwer, M, Humernbrum, T, und Gorlatch, S. 2016. „Multi-Stage Programming for GPUs in Modern C++ using PACXX.“ Beitrag präsentiert auf der The 9th Annual Workshop on General Purpose Processing Using Graphics Processing Unit, GPGPU '16, Barcelona, Spain New York, NY, USA: ACM Press. doi: 10.1145/2884045.2884049.
Winands, T, Böckmann, M, Schemme, T, Timmy, LyP-M, de Jong, DH, Wang, Z, Denz, C, Heuer, A, und Doltsinis, NL. 2016. „P3HT:DiPBI bulk heterojunction solar cells: morphology and electronic structure probed by multiscale simulation and UV/vis spectroscopy.“ Physical Chemistry Chemical Physics 18. doi: 10.1039/C5CP06704A.
Wang, D, de Jong, DH, Rühling, A, Lesch, V, Shimizu, K, Wulff, S, Heuer, A, Glorius, F, und Galla, H-J. 2016. „Imidazolium-based lipid analogues and their interaction with phosphatidylcholine membranes.“ Langmuir 145: 204507..
Schmidt, R., Niehues, I., Schneider, R., Drüppel, M., Deilmann, T., Rohlfing, M., De Vasconcellos, S., Castellanos-Gomez, A., und Bratschitsch, R. 2016. „Reversible uniaxial strain tuning in atomically thin WSe2.“ 2D Materials 3 (2). doi: 10.1088/2053-1583/3/2/021011.
2015
Förster, T, Krüger, P, und Rohlfing, M. 2015. „Two-dimensional topological phases and electronic spectrum of Bi2Se3 thin films from GW calculations.“ Physical Review B - Condensed Matter 92 (20): 201404.. doi: 10.1103/PhysRevB.92.201404.
Sinha, I, Hepp, A, Schirmer, B, Kösters, J, Neugebauer, J, und Müller, J. 2015. „Regioselectivity of the C-Metalation of 6-Furylpurine: Importance of Directing Effects.“ Journal of the American Chemical Society 54: 4183–4185. doi: 10.1021/acs.inorgchem.5b00450.
Förster, T, Krüger, P, und Rohlfing, M. 2015. „Ab initio studies of adatom- and vacancy-induced band bending in Bi2Se3.“ Physical Review B - Condensed Matter 91 (3): 035313.. doi: 10.1103/PhysRevB.91.035313.
Bulava, J., Morte, M., Heitger, J., und Wittemeier, C. 2015. „Non-perturbative improvement of the axial current in N<inf>f</inf>=3 lattice QCD with Wilson fermions and tree-level improved gauge action.“ Nuclear Physics B 896: 555–568. doi: 10.1016/j.nuclphysb.2015.05.003.
Uhl, W, Wegener, P., und Würthwein, E.-U. 2015. „Dehydrochlorination of Carboxylic Acid Chlorides by an Aluminium/Phosphorus-Based Frustrated Lewis Pair and the Formation of Ketene Adducts.“ Z. Anorg. Allgem. Chem. 641: 2102–2108.
Bergner, G, Giudice, P, Montvay, I, Münster, G, und Piemonte, S. 2015. „Lattice simulations of technicolour theories with adjoint fermions and supersymmetric Yang-Mills theory.“ In Proceedings of the 33rd International Symposium on Lattice Field Theory (Lattice 2015), PoS(LATTICE 2015)
Lesch, V, Heuer, A, Tatsis, VA, Holm, C, und Smiatek, J. 2015. „Peptides in Presence of Aqueous Ionic Liquids:Tunable Co-Solutes as Denaturants or Protectants?“ Phys. Chem. Chem. Phys. 2015: 26049–26053.
Böckmann, M, Schemme, T, de Jong, DH, Denz, C, Heuer, A, und Doltsinis, NL. 2015. „Structure of P3HT crystals, thin films, and solutions by UV/Vis spectral analysis.“ Phys. Chem. Chem. Phys. 2015.
Chattoraj, J, Knappe, M, und Heuer, A. 2015. „Dependence of Ion Dynamics on the Polymer Chain Length in Poly(Ethylene Oxide)-Based Polymer Electrolytes.“ J. Phys. Chem. B 2015: 6786–6791.
Lesch, V, Heuer, A, Holm, C, und Smiatek, J. 2015. „Solvent effects of 1-ethyl-3-methylimidazolium acetate: Solvation and dynamic behavior of polar and apolar solutes.“ Phys. Chem. Chem. Phys. 2015: 8480–8490.
Wagner, C., Green, M., Leinen, P., Deilmann, T., Krüger, P., Rohlfing, M., Temirov, R., und Tautz, F. 2015. „Scanning Quantum Dot Microscopy.“ Physical Review Letters 115 (2). doi: 10.1103/PhysRevLett.115.026101.
Bergner, G, Giudice, P, Montvay, I, Münster, G, und Piemonte, S. 2015. „Influence of topology on the scale setting.“ Eur. Phys. J. Plus 130: 229.
Bergner, G, Giudice, P, Montvay, I, Münster, G, und Piemonte, S. 2015. „The low-lying spectrum of N=1 supersymmetric Yang-Mills theory.“ Beitrag präsentiert auf der EPS Conference on High-Energy Physics (EPS-HEP 2015), Wien
Bergner, G, Giudice, P, Montvay, I, Münster, G, und Piemonte, S. 2015. „Supermultiplets of the N=1 supersymmetric Yang-Mills theory in the continuum limit.“ In Proceedings of the 33rd International Symposium on Lattice Field Theory (Lattice 2015), PoS(LATTICE 2015)
Bergner, G, Giudice, P, Münster, G, und Piemonte, S. 2015. „Witten index and phase diagram of compactified N=1 supersymmetric Yang-Mills theory on the lattice.“ In Proceedings of the 33rd International Symposium on Lattice Field Theory (Lattice 2015), PoS(LATTICE 2015)
Choksuchat, C, Chantrapornchai, C, Haidl, M, und Gorlatch, S. 2015. „Accelerating Keyword Search for Large RDF Data on Many-Core Systems.“ Beitrag präsentiert auf der The 14th International Conference on Intelligent Software Methodologies, Tools and Techniques, Naples, Italy
Borisenko, A, Haidl, M, und Gorlatch, S. 2015. „Parallelizing Branch-and-Bound on GPUs for Optimization of Multiproduct Batch Plants.“ In Parallel Computing Technologies, Bd. 9251 aus Lecture Notes in Computer Science, herausgegeben von Springer Cham: Springer. doi: 10.1007/978-3-319-21909-7_33.
Tussing, S., Greb, L., Tamke, S., Schirmer, B., Muhle-Goll, C., Luy, B., und Paradies, J. 2015. „Autoinduced catalysis and inverse equilibrium isotope effect in the frustrated lewis pair-catalyzed hydrogenation of imines.“ Chemistry - A European Journal null (null). doi: 10.1002/chem.201500805.
Esat, T, Deilmann, T, Lechtenberg, B, Wagner, C, Krüger, P, Temirov, R, Anders, FB, Rohlfing, M, und Tautz, FS. 2015. „Transfering spin into an extended π orbital of a large molecule.“ Phys. Rev. B 91: 144415.. doi: 10.1103/PhysRevB.91.144415.
Diddens, D, und Heuer, A. 2015. „Chain End Mobilities in Polymer Melts - A Computational Study.“ J. Chem. Phys. 142: 014906.. doi: 10.1063/1.4905238.
2014
Wagner, C., Fournier, N., Ruiz, V.G., Li, C., Müllen, K., Rohlfing, M., Tkatchenko, A., Temirov, R., und and, Tautz F.S. 2014. „Non-additivity of molecule-surface van der Waals potentials from force measurements.“ Nature Communications 5: 5568. doi: 10.1038/ncomms6568.
Steuwer, Michel, Haidl, Michael, Breuer, Stefan, und Gorlatch, Sergei. 2014. „High-Level Programming of Stencil Computations on Multi-GPU Systems using the SkelCL Library.“ Parallel Processing Letters 24 (03): 1441005. doi: 10.1142/S0129626414410059.
Smiatek, J, Janssen-Mueller, D, Friedrich, R, und Heuer, A. 2014. „Systematic detection of hidden complexities in the unfolding mechanism of a cytosine-rich DNA strand.“ Physica A 394: 136–144..
Bulava, J., Della, Morte M., Heitger, J., und Wittemeier, C. 2014. „Non-perturbative improvement and renormalization of the axial current in N_f=3 lattice QCD.“ In LATTICE 2014, Bd. LATTICE2014 aus Proceedings of Science Proceedings of Science.
Lesch, V, Jeremias, S, Moretti, A, Passerini, S, Heuer, A, und Borodin, OA. 2014. „Combined Theoretical and Experimental Study of the Influence of Different Anion Ratios on Lithium Ion Dynamics in Ionic Liquids.“ J. Phys. Chem. B 118: 7367–7375.
Smiatek, J, und Heuer, A. 2014. „Deprotonation mechanism of a single-stranded DNA i-motif.“ RSC Advances 4: 17110–17113.
Hakobyan, D, und Heuer, A. 2014. „Key Molecular Requirements for Raft Formation in Lipid/Cholesterol Membranes.“ PloS one 9 (2): e87369..
Diddens, D, und Heuer, A. 2014. „Simulation Study of the Lithium Ion Transport Mechanism in Ternary Polymer Electrolytes: The Critical Role of the Segmental Mobility,.“ Phys. Chem. B 118: 1113–1125.
Bergner, G, Giudice, P, Montvay, I, Münster, G, Özugurel, U, Piemonte, S, und Sandbrink, D. 2014. „Latest lattice results of N=1 supersymmetric Yang-Mills theory with some topological insights.“ In Proceedings of the 32nd International Symposium on Lattice Field Theory "Lattice 2014", PoS(LATTICE2014)
Bergner, G, Giudice, P, Münster, G, Piemonte, S, und Sandbrink, D. 2014. „First studies of the phase diagram of N=1 supersymmetric Yang-Mills theory.“ In Proceedings of the 32nd International Symposium on Lattice Field Theory "Lattice 2014", PoS(LATTICE2014)
Bergner, G, Giudice, P, Münster, G, Piemonte, S, und Sandbrink, D. 2014. „Phase structure of the N=1 supersymmetric Yang-Mills theory at finite temperature.“ Journal of High Energy Physics (JHEP) 2014 (11): 049. doi: 10.1007/JHEP11(2014)049.
Dütsch, Fabian, Djelassi, Karim, Haidl, Michael, und Gorlatch, Sergei. 2014. „HLSF: A High-Level, C++-Based Framework for Stencil Computations on Accelerators.“ Beitrag präsentiert auf der Second Workshop on Optimizing Stencil Computations WOSC'14 at SPLASH 14, Portland New York: ACM Press. doi: 10.1145/2686745.2686751.
Haidl, Michael, und Gorlatch, Sergei. 2014. „PACXX: Towards a Unified Programming Model for Programming Accelerators using C++14.“ In LLVM-HPC '14 Proceedings of the 2014 LLVM Compiler Infrastructure in HPC Piscataway, NJ, USA: Wiley-IEEE Press. doi: 10.1109/LLVM-HPC.2014.9.
Carnein, Matthias, Schöttle, Pascal, und Böhme, Rainer. 2014. „Predictable Rain? Steganalysis of Public-key Steganography Using Wet Paper Codes.“ In Proceedings of the 2nd ACM Workshop on Information Hiding and Multimedia Security (IH & MMSec '14), herausgegeben von Andreas Unterweger, Andreas Uhl, Stefan Katzenbeisser, Roland Kwitt und Alessandro Piva. New York, NY, USA: ACM Press. doi: 10.1145/2600918.2600942.
Quiring, Erwin, und Schöttle, Pascal. 2014. „On the Combination of Randomized Thresholds and Non-Parametric Boundaries to Protect Digital Watermarks against Sensitivity Attacks.“ In IH&MMSec 14 Proceedings of the 2014 ACM Information Hiding and Multimedia Security Workshop ACM Press.
Gorlatch, Sergei, und Steuwer, Michel. 2014. „Towards High-Level Programming for Systems with Many Cores.“ In Perspectives of Systems Informatics - 9th International Andrei Ershov Memorial Conference, PSI 2014, Lecture Notes in Computer Schience, herausgegeben von Alexander Marchuk und Andrey Terekhov. Springer.
Steuwer, Michel, und Gorlatch, Sergei. 2014. „SkelCL: a high-level extension of OpenCL for multi-GPU systems.“ The Journal of Supercomputing 69 (1): 25–33. doi: 10.1007/s11227-014-1213-y.
Deilmann, T., Kruger, P., Rohlfing, M., und Wegner, D. 2014. „Adsorption and STM imaging of tetracyanoethylene on Ag(001): An ab initio study.“ Physical Review B 89 (4). doi: 10.1103/PhysRevB.89.045405.
Bergner, G, Montvay, I, Münster, G, Özugurel, U, und Sandbrink, D. 2014. „Numerical simulation of supersymmetric Yang-Mills theory.“ In Proceedings of the NIC Symposium 2014, Bd. 47 aus NIC Series Jülich.
Chattoraj, J, Diddens, D, und Heuer, A. 2014. „Effects of ionic liquids on cation dynamics in amorphous polyethylene oxide electrolytes.“ The Journal of Chemical Physics 140 (2): 024906..
Breuer, Stefan, Steuwer, Michel, und Gorlatch, Sergei. 2014. „Extending the SkelCL Skeleton Library for Stencil Computations on Multi-GPU Systems.“ In Proceedings of the 1st International Workshop on High-Performance Stencil Computations, herausgegeben von A Größlinger und H Köstler. Wien: International Workshop on High-Performance Stencil Computations.
Steuwer, Michel, Friese, Malte, Albers, Sebastian, und Gorlatch, Sergei. 2014. „Introducing and Implementing the Allpairs Skeleton for Programming Multi-GPU Systems.“ International Journal of Parallel Programming 42 (4): 601–618. doi: 10.1007/s10766-013-0265-6.
2013
Jiang, Y, Schirmer, B, Blacque, O, Fox, T, Grimme, S, und Berke, H. 2013. „The "Catalytic Nitrosyl Effect’ —NO Bending Boosting the Efficiency of Rhenium Based Alkene Hydrogenations.“ Journal of the American Chemical Society 135 (10): 4088–4102. doi: 10.1021/ja400135d.
Schirmer, B, und Grimme, S. 2013. „Quantum Chemistry of FLPs and Their Activation of Small Molecules: Methodological Aspects.“ In Frustrated Lewis Pairs I, Topics in Current Chemistry, herausgegeben von G Erker und DW Stephan. Springer VDI Verlag. doi: 10.1007/128_2012_389.
Smiatek, J, Harishchandra, RK, Galla, H-J, und Heuer, A. 2013. „Low concentrated hydroxyectoine solutions in presence of DPPC lipid bilayers: A computer simulation study.“ Biophysical Chemistry 180-181: 102–109..
Bulava, J, Della, Morte M, Heitger, J, und Wittemeier, C. 2013. „Determination of c_A in three-flavour lattice QCD with Wilson fermions and tree-level improved gauge action.“ In LATTICE 2013, Bd. LATTICE2013 aus Proceedings of Science Proceedings of Science.
Bergner, G, Montvay, I, Münster, G, Özugurel, U, und Sandbrink, D. 2013. „N=1 supersymmetric Yang-Mills theory on the lattice.“ In Proceedings of the 31th International Symposium on Lattice Field Theory "Lattice 2013", Bd. PoS(LATTICE 2013)
Bergner, G, Montvay, I, Münster, I, Özugurel, U, und Sandbrink, U. 2013. „Towards the spectrum of low-lying particles in supersymmetric Yang-Mills theory.“ Journal of High Energy Physics (JHEP) 2013 (11): 061. doi: 10.1007/JHEP11(2013)061.
Ernst-Hullermann, J, Harder, H, und Hansen, U. 2013. „Finite volume simulations of dynamos in ellipsoidal planets.“ Geophys. J. Int. 195: 1395–1405. doi: 10.1093/gji/ggt303.
Kegel, Philipp, Steuwer, Michel, und Gorlatch, Sergei. 2013. „dOpenCL: Towards uniform programming of distributed heterogeneous multi-/many-core systems.“ Journal of Parallel and Distributed Computing 73 (12): 1639–1648. doi: 10.1016/j.jpdc.2013.07.021.
Kegel, Philipp. 2013. „A Uniform, OpenCL-based Approach for Programming Distributed Systems With Multicores and GPUs.“ Dissertationsschrift, University of Münster.
Greb, L, Tussing, S, Schirmer, B, Ona-Burgos, P, Kaupmees, K, Lokov, M, Leito, I, Grimme, S, und Paradies, J. 2013. „Electronic effects of triarylphosphines in metal-free hydrogen activation: a kinetic and computational study.“ Chemical science ASAP: –.. doi: 10.1039/C3SC50347J.
Steuwer, Michel, und Gorlatch, Sergei. 2013. „SkelCL: Enhancing OpenCL for High-Level Programming of Multi-GPU Systems.“ In Parallel Computing Technologies - 12th International Conference (PaCT 2013), Bd. 7979 aus Lecture Notes in Computer Science, herausgegeben von Malyshkin Victor Springer. doi: 10.1007/978-3-642-39958-9_24.
Kegel, Philipp, Steuwer, Michel, und Gorlatch, Sergei. 2013. „Uniform High-Level Programming of Many-Core and Multi-GPU Systems.“ In Transition of HPC Towards Exascale Computing, Bd. 24 aus Advances in Parallel Computing, herausgegeben von Erik D'Hollander, Jack Dongarra, Ian Foster, Lucio Grandinetti und Gerhard Joubert. IOS Press. doi: 10.3233/978-1-61499-324-7-159.
Steuwer, Michel, und Gorlatch, Sergei. 2013. „High-Level Programming for Medical Imaging on Multi-GPU Systems using the SkelCL Library.“ Procedia Computer Science 18: 749–758. doi: 10.1016/j.procs.2013.05.239.
Hirtz, M, Kumar, N, Franke, JH, Hao, J, Lu, N, Fuchs, H, und Chi, LF. 2013. „Selective deposition of organic molecules onto DPPC templates-a molecular dynamics study.“ Journal of Colloid and Interface Science 389 (1): 206–212. doi: 10.1016/j.jcis.2012.09.024.
2012
Papenkort, T, Axt, VM, und Kuhn, T. 2012. „Optical excitation of squeezed longitudinal optical phonon states in an electrically biased quantum well.“ Physical Review B 85 (23): 235317. doi: 10.1103/PhysRevB.85.235317.
Bergner, G, Berheide, T, Münster, G, Özugurel, UD, Sandbrink, D, und Montvay, I. 2012. „The gluino-glue particle and finite size effects in supersymmetric Yang-Mills theory.“ Journal of High Energy Physics (JHEP) 2012 (9): 108–124. doi: 10.1007/JHEP09/282012/29108.
Fuks, B, Klasen, M, Lamprea, DR, und Rothering, M. 2012. „Gaugino production in proton-proton collisions at a center-of-mass energy of 8 TeV.“ Journal of High Energy Physics (JHEP) 2012 (10). doi: 10.1007/JHEP10(2012)081.
Klasen, M, Kovařík, K, Nason, P, und Weydert, C. 2012. „Associated production of charged Higgs bosons and top quarks with POWHEG.“ European Physical Journal C: Particles and Fields 72 (9): –.. doi: 10.1140/epjc/s10052-012-2088-9.
Soltwisch, J, Jaskolla, TW, Hillenkamp, F, Karas, M, und Dreisewerd, K. 2012. „Ion Yields in UV-MALDI Mass Spectrometry As a Function of Excitation Laser Wavelength and Optical and Physico-Chemical Properties of Classical and Halogen-Substituted MALDI Matrixes.“ Analytical Chemistry 84 (15): 6567–76. doi: 10.1021/ac3008434.
Jezo, T, Klasen, M, und Schienbein, I. 2012. „LHC phenomenology of general SU(2)xSU(2)xU(1) models.“ Physical Review D - Particles, Fields, Gravitation, and Cosmology 86 (3): –.. doi: 10.1103/PhysRevD.86.035005.
Fuks, B, Herrmann, B, und Klasen, M. 2012. „Phenomenology of anomaly-mediated supersymmetry-breaking scenarios with nonminimal flavor violation.“ Physical Review D - Particles, Fields, Gravitation, and Cosmology 86 (1): –.. doi: 10.1103/PhysRevD.86.015002.
Schöttle, Pascal, Korff, Stefan, und Böhme, Rainer. 2012. „Weighted Stego-Image Steganalysis for Naive Content-Adaptive Embedding.“ Beitrag präsentiert auf der IEEE International Workshop on Information Forensics and Security (WIFS), Teneriffa
Kegel, Philipp, Steuwer, Michel, und Gorlatch, Sergei. 2012. „dOpenCL: Towards a uniform programming approach for distributed heterogeneous multi-/many-core systems.“ In Proceedings of the 2012 IEEE 26th International Parallel and Distributed Processing Symposium Workshops, IPDPSW 2012 Wiley-IEEE Computer Society Press. doi: 10.1109/IPDPSW.2012.16.
Steuwer, Michel, Gorlatch, Sergei, Buß, Matthias, und Breuer, Stefan. 2012. „Using the SkelCL Library for High-Level GPU Programming of 2D Applications.“ In Euro-Par 2012: Parallel Processing Workshops - BDMC, CGWS, HeteroPar, HiBB, OMHI, Paraphrase, PROPER, Resilience, UCHPC, VHPC, Rhodes Islands, Greece, August 27-31, 2012. Revised Selected Papers, Bd. 7640 aus Lecture Notes in Computer Science, herausgegeben von Ioannis Caragiannis, Michael Alexander, Rosa M. Badia, Mario Cannataro, Alexandru Costan, Marco Danelutto, Frederic Desprez, Bettina Krammer, Julio Sahuquillo, Stephen L. Scott und Josef Weidendorfer. Rhodes Islands, Greece: Springer. doi: 10.1007/978-3-642-36949-0_41.
Steuwer, Michel, Kegel, Philipp, und Gorlatch, Sergei. 2012. „A High-Level Programming Approach for Distributed Systems with Accelerators.“ In New Trends in Software Methodologies, Tools and Techniques - Proceedings of the Eleventh SoMeT '12, herausgegeben von Hamido Fujita und Roberto Revetria. Amsterdam: IOS Press. doi: 10.3233/978-1-61499-125-0-430.
Michel, K., Glotzbach, C., Fröhlich, R., und Würthwein, E.-U. 2012. „[1,4]Dithiepino[2,3-b]furans from Oxiranyl Carbaldimines and Lithiated 1,3-Dithiane: A Series of Rearrangement Reactions in One Pot.“ Eur. J. Org. Chem. 2012: 960–966. doi: 10.1002/ejoc.201101323.
Clodt, J.I., Fröhlich, R., Eul, M., und Würthwein, E.-U. 2012. „Metallomacrocyclic Complexes by Self-assembly of NiII and CuII Ions and Chelating Bis(N-acylamidines).“ Eur. J. Inorg. Chem. 2012: 1210–1217. doi: 10.1002/ejic.201101350.
Uhl, W., Heller, D., Kösters, J., Würthwein, E.-U., und Ghavtadze, N. 2012. „Hydroalumination of Bis(alkynyl)-silanes, Generation of Chelating Lewis-Acids, Their Application in the Coordination of Chloride Ions and a 1,1-Carbalumination Reaction.“ Eur. J. Inorg. Chem. 2012: 1359–1368. doi: 10.1002/ejic.201100890.
Neue, B., Fröhlich, R., Wibbeling, B., Fukazawa, A., Wakamiya, A., Yamaguchi, S., und Würthwein, E.-U. 2012. „Synthesis and Photophysical Properties of Aryl Substituted 2-Borylbenzaldimines and their Extended π-Conjugated Congeners.“ J. Org. Chem. 77: 2176–2184. doi: 10.1021/jo202212sl.
Holtrichter-Rößmann, T., Rösener, C., Hellmann, J., Uhl, W., Würthwein, E.-U., Fröhlich, R., und Wibbeling, B. 2012. „Generation of Weakly Bound Al-N Lewis-Pairs by Hydroalumination of Ynamines and the Activation of Small Molecules: Phenylethyne and Dicyclohexylcarbodiimide.“ Organometallics 31: 3272–3283. doi: 10.1021/om3001179.
Bergner, G, Montvay, I, Münster, G, Özugurel, UD, und Sandbrink, D. 2012. „The gluino-glue particle and relevant scales for the simulations of supersymmetric Yang-Mills theory.“ In Proceedings of the 30th International Symposium on Lattice Field Theory "Lattice 2012", Bd. PoS(Lattice 2012)
Ernsting, Steffen, und Kuchen, Herbert. 2012. „Algorithmic skeletons for multi-core, multi-GPU systems and clusters.“ International Journal of Oil, Gas and Coal Technology 7 (2): 129–138. doi: 10.1504/IJHPCN.2012.046370.
Ernsting, Steffen, und Kuchen, Herbert. 2012. „Data Parallel Skeletons in Java.“ Procedia Computer Science 9: 1817–1826. doi: 10.1016/j.procs.2012.04.200.
Drohmann, M, Haasdonk, B, und Ohlberger, M. 2012. „Reduced Basis Approximation for Nonlinear Parametrized Evolution Equations based on Empirical Operator Interpolation.“ SIAM Journal on Scientific Computing 34: A937–A969.. doi: 10.1137/10081157X.
Linden, S, Zhong, D, Timmer, A, Aghdassi, N, Franke, J, Zhang, H, Feng, X, Müllen, K, Fuchs, H, Chi, LF, und Zacharias, H. 2012. „Electronic Structure of Spatially Aligned Graphene Nanoribbons on Au(788).“ Physical Review Letters 108 (21): 216801–216805. doi: 10.1103/PhysRevLett.108.216801.
Eich, S.M., Kaprzak, M., Gusak, A., und Schmitz, G. 2012. „On the mechanism of diffusion-induced recrystallization: Comparison between experiment and molecular dynamics simulations.“ Acta Materialia 60 (8): 3469–3479. doi: 10.1016/j.actamat.2012.03.009.
Kessler, Christoph, Gorlatch, Sergei, Enmyren, Johan, Dastgeer, Usman, Steuwer, Michel, und Kegel, Philipp. 2012. „Skeleton Programming for Portable Many-Core Computing.“ In Programming Multi-core and Many-core Computing Systems, Parallel and Distributed Computing, herausgegeben von Sabri Pllana und Fatos Xhafa. Wiley-Blackwell.
Steuwer, Michel, Kegel, Philipp, und Gorlatch, Sergei. 2012. „Towards High-Level Programming of Multi-GPU Systems Using the SkelCL Library.“ In Proceedings of the 2012 IEEE 26th International Parallel and Distributed Processing Symposium Workshops, IPDPSW 2012, herausgegeben von IEEE Shanghai: Wiley-IEEE Press. doi: 10.1109/IPDPSW.2012.229.
King, E.M., Stellmach, S., und Aurnou, J.M. 2012. „Heat Transfer by Rapidly Rotating Rayleigh-Bénard Convection.“ Journal of Fluid Mechanics 691: 568–582. doi: 10.1017/jfm.2011.493.
Ernsting, Steffen, und Kuchen, Herbert. 2012. „Data Parallel Skeletons for GPU Clusters and Multi-GPU Systems.“ Beitrag präsentiert auf der Parallel Conference 2011 (ParCo11), Gent, Belgien
2011
Debove, J, Fuks, B, und Klasen, M. 2011. „Threshold resummation for gaugino pair production at hadron colliders.“ Nuclear Physics B 842 (1): 51–85. doi: 10.1016/j.nuclphysb.2010.08.016.
Debove, J, Fuks, B, und Klasen, M. 2011. „Joint resummation for gaugino pair production at hadron colliders.“ Nuclear Physics B 849 (1): 64–79. doi: 10.1016/j.nuclphysb.2011.03.015.
Herrmann, B, Klasen, M, und Le Boulc'h, Q. 2011. „Impact of squark flavor violation on neutralino dark matter.“ Physical Review D - Particles, Fields, Gravitation, and Cosmology 84 (9): –.. doi: 10.1103/PhysRevD.84.095007.
Klasen, M, und Kramer, G. 2011. „Dijet photoproduction of massless charm jets at next-to-leading order of QCD.“ European Physical Journal C: Particles and Fields 71 (10): –.. doi: 10.1140/epjc/s10052-011-1774-3.
Steuwer, Michel, Kegel, Philipp, und Gorlatch, Sergei. 2011. „SkelCL - A Portable Skeleton Library for High-Level GPU Programming.“ In 2011 IEEE International Symposium on Parallel and Distributed Processing Workshops and Phd Forum (IPDPSW) Wiley-IEEE Press. doi: 10.1109/IPDPS.2011.269.
Kegel, Philipp, Schellmann, Maraike, und Gorlatch, Sergei. 2011. „Comparing Programming Models for Medical Imaging on Multi-Core Systems.“ Concurrency and Computation: Practice and Experience 23 (10): 1051–1065. doi: 10.1002/cpe.1671.
Borisenko, Andrey, Kegel, Philipp, und Gorlatch, Sergei. 2011. „Optimal Design of Multiproduct Batch Plants Using a Parallel Branch-and-Bound Method.“ Beitrag präsentiert auf der PaCT 2011, Kanzan, Rusia
Drohmann, M, Haasdonk, B, und Ohlberger, M. 2011. „Adaptive Reduced Basis Methods for Nonlinear Convection-Diffusion Equations.“ In Finite Volumes for Complex Applications VI - Problems & Perspectives, Bd. 4 (1) aus Springer Proceedings in Mathematics, herausgegeben von Fort J. et al. Springer. doi: 10.1007/978-3-642-20671-9_39.
Bergner, G, Montvay, I, Münster, G, Özugurel, U, und Sandbrink, D. 2011. „Supersymmetric Yang-Mills theory: a step towards the continuum.“ In Proceedings of the XXIX International Symposium on Lattice Field Theory "Lattice 2011", Bd. PoS(Lattice 2011)
2010
Garaud, P, Ogilvie, GI, Miller, N, und Stellmach, S. 2010. „A model of the entropy flux and Reynolds stress in turbulent convection.“ Monthly Notices of the Royal Astronomical Society 407 (4): 2451–2467. doi: 10.1111/j.1365-2966.2010.17066.x.
Papenkort, T, Kuhn, T, und Axt, VM. 2010. „Resonant generation of coherent LO phonons by charge oscillations in a biased quantum well.“ Physical Review B 81 (20): 205320. doi: 10.1103/PhysRevB.81.205320.
Stephan, S, und Hansen, U. 2010. „Turbulent Rotating Rayleigh-Bénard Convection.“ IAS Series 33: 305–312.
2009
Zhong, DY, Franke, J, Blömker, T, Erker, G, Chi, LF, und Fuchs, H. 2009. „Manipulating Surface Diffusion Ability of Single Molecules by Scanning Tunneling Microscopy.“ Nano Letters 9 (1): 132–136. doi: 10.1021/nl802677c.
King, EM, Stellmach, S, Noir, J, Hansen, U, und Aurnou, JM. 2009. „Boundary layer control of rotating convection systems.“ Nature 457 (7227): 301–304. doi: 10.1038/nature07647.
Johannes, Wicht, und Stephan, Stellmach und Helmut Harder. 2009. „Numerical Models of the Geodynamo: From Fundamental Cartesian Models to 3D Simulations of Field Reversals.“ In GEOMAGNETIC FIELD VARIATIONS, Advances in Geophysical and Environmental Mechanics and Mathematics, herausgegeben von Glassmeier Karl-Heinz, Soffel Heinrich und F.W. Negendank Jörg. Berlin Heidelberg: Springer VDI Verlag. doi: 10.1007/978-3-540-76939-2_4.
2008
Franke, JH, Caciuc, V, Chi, LF, und Fuchs, H. 2008. „Adsorption and bonding mechanism of a N,N-'-di(n-butyl)quinacridone monolayer studied by density functional theory including semiempirical dispersion corrections.“ Physical Review B 78 (16). doi: 10.1103/PhysRevB.78.165432.
Stellmach, S, und Hansen, U. 2008. „An efficient spectral method for the simulation of dynamos in Cartesian geometry and its implementation on massively parallel computers.“ Geochemistry, Geophysics, Geosystems 9. doi: 10.1029/2007GC001778.
Meyer, K, Raker, T, Niedernostheide, FJ, und Kuhn, T. 2008. „Hydrodynamic modeling of charge carrier transport and transverse pattern formation in ZnS : Mn thin-film electroluminescent structures.“ Physical Review B 77 (4): 045321. doi: 10.1103/PhysRevB.77.045321.
2007
Papenkort, T, Axt, VM, und Kuhn, T. 2007. „Coherent dynamics and pump-probe spectra of BCS superconductors.“ Physical Review B 76 (22): 224522. doi: 10.1103/PhysRevB.76.224522.
2006
Meyer, K, Raker, T, Niedernostheide, F-J, und Kuhn, T. 2006. „Hydrodynamic and drift-diffusion modelling of charge carrier transport in ZnS:Mn thin-film electroluminescent structures.“ Semiconductor Science and Technology 21 (4): 565–574. doi: 10.1088/0268-1242/21/4/025.
Hoink, T, Schmalzl, J, und Hansen, U. 2006. „Dynamics of metal-silicate separation in a terrestrial magma ocean.“ Geochemistry, Geophysics, Geosystems 7. doi: 10.1029/2006GC001268.
2005
Hoink, T, Schmalzl, J, und Hansen, U. 2005. „Formation of compositional structures by sedimentation in vigorous convection.“ Physics of the Earth and Planetary Interiors 153 (1-3): 11–20. doi: 10.1016/j.pepi.2005.03.014.
2004
Stellmach, S, und Hansen, U. 2004. „Cartesian convection driven dynamos at low Ekman number.“ Physical Review E - Statistical, nonlinear, and soft matter physics 70 (5). doi: 10.1103/PhysRevE.70.056312.
Harder, H, Stellmach, S., und Hansen, U. 2004. „Magnetohydrodynamic Simulations of the Geodynamo.“ NIC Series 20: 389–398.
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