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An overview of all publications that were created in the course of hpc.bw or with help of resources from the project. Computational resources (HPC cluster HSUper / ISCC) have been provided by the project hpc.bw, funded by dtec.bw – Digitalization and Technology Research Center of the Bundeswehr. dtec.bw is funded by the European Union – NextGenerationEU.

 

AuthorsYearTitlePublisher InformationTypeLink
Abdelsayed, M., Hasslberger, J., Ertl, M., Weigand, B. & Klein, M.2024Toward large eddy simulation of shear-thinning liquid jets. A priori analysis of subgrid scale closures for multiphase flowsPhysics of Fluids, Volume 36, Issue 8 (2024), AIP PublishingJournal article🔗
Abdelsayed, M., Trautner, E. & Klein, M.2023Detailed numerical investigation of the effect of nozzle flow on primary atomization of liquid jets14th International ERCOFTAC Symposium on Engineering Turbulence Modelling and MeasurementsConference Paper🔗
Abdelsayed, M., Trautner, E., Berchtenbreiter, J. & Klein, M.2024Primary atomization of shear-thinning liquid jets: A Direct Numerical Simulation studyScientific Reports 14, 23896 (2024), Nature ResearchJournal article🔗
Anselmann, M. & Bause, M.2023A Geometric Multigrid Method for Space-Time Finite Element Discretizations of the Navier–Stokes Equations and its Application to 3D Flow SimulationACM Transactions on Mathematical Software, Vol. 49 (2023), No. 1, Art. 5, Association for Computing MachineryJournal article🔗
Anselmann, M., Bause, M., Margenberg, N. & Shamko, P.2024An energy-efficient GMRES–multigrid solver for space-time finite element computation of dynamic poroelasticityComputational Mechanics, Vol. 74 (2024), pp. 889-912, Springer NatureJournal article🔗
Anselmann, M., Bause, M., Margenberg, N. & Shamko, P.2023Benchmark computations of dynamic poroelasticityProceedings in Applied Mathematics and Mechanics, 23, e202300096Journal article🔗
Bause, M. & Anselmann, M.2025Optimal order FEM for dynamic poroelasticity: Error analysis for equal order elementsSequeira, A. et al. (eds.), Numerical Mathematics and Advanced Applications ENUMATH 2023, Volume 1, Lect. Notes Comput. Sci. Eng., pp. 119-138.Book chapter🔗
Bause, M., Franz, S. & Anselmann, M.2025Structure preserving discontinuous Galerkin approximation of a hyperbolic-parabolic systemElectron. Trans. Numer. Anal., 63 (2025), pp. 1–32, Kent State UniversityJournal article🔗
Boulbrachene, K. & Breuer, M.2024A numerical method to mimic an experimental wind gust generator: The immersed boundary gust generatorPhysics of Fluids 1, Vol. 36, Issue 1 (2024), AIP Publishing.Journal article🔗
Boulbrachene, K. & Breuer, M.2025A dynamic immersed boundary method for simulating an adaptive nozzle generating discrete wind gustsComputers and Fluids Vol. 301 (2025), 106775, Japan Concrete InstituteJournal article🔗
Breuer, M., Boulbrachene, K., & De Nayer, G.2025Combination of two FSI methods and their validation based on artificial wind gusts impacting a flexible T-structureComputer & Fluids, Vol. 294, (2025), 106621, ElsevierJournal article🔗
Bruchhäuser, M. P. & Bause, M.2025Numerical study of approximation techniques for the temporal weights to the DWR methodSequeira, A. et al. (eds.), Numerical Mathematics and Advanced Applications ENUMATH 2023, Volume 1, Lect. Notes Comput. Sci. Eng., pp. 177-187.Book chapter🔗
Bursik, B., Bender, F., Stierle, R., Bauer, G. & Gross, J.2025Predicting Mass Transfer Through Interfaces Using Hydrodynamic Density Functional TheoryInternational Conference on Properties and Phase Equilibria for Product and Process DesignConference Poster🔗
Das Sharma, A., Horn, R. & Philipp, N.2024The Error-Energy Tradeoff in Molecular and Molecular-Continuum Fluid SimulationsThe Proceedings of International Conference on High Performance Computing in Asia-Pacific Region Workshops (Multi-scale, Multi-physics and Coupled Problems on highly parallel systems), Association for Computing MachineryePaper🔗
Das Sharma, A., Viot, L., Jarmatz, P., Preuß, H., & Neumann, P.2025Static Load Balancing for Molecular-Continuum Flow Simulations with Heterogeneous Particle Systems and on Heterogeneous HardwareLees, M.H., et al. Computational Science – ICCS 2025. ICCS 2025. Lecture Notes in Computer Science, vol 15905. Springer, Cham.Book chapter🔗
De Nayer, G. & Breuer, M.2023Surrogate-based optimization for the worst-case prediction regarding a flexible structure impacted by wind gustsJournal of Wind Engineering & Industrial Aerodynamics 243 (2023) 105610, ElsevierJournal article🔗
De Nayer, G., Goldbach, A.K. & Breuer, M.2024Fluid-structure interaction simulations of wind gusts impacting a hyperbolic paraboloid tensile structurePhysics of Fluids 1 October 2024; 36 (10): 105152, AIP PublishingJournal article🔗
Dethof, F.2024Explaining impact echo geometry effects using modal analysis theory and numerical simulationsNDT & E International, Vol. 143 (2024), 103035, ElsevierJournal article🔗
Dethof, F.2024Factors Influencing Impact Echo Simulations in Thick Concrete StructuresJournal of Advanced Concrete Technology, 2024, Volume 22, Issue 10, Pages 636-649, Japan Concrete InstituteJournal article🔗
Dethof, F. & Kessler, S.2023Automated honeycomb detection during Impact Echo inspections in concrete using AI trained by simulation dataSpecial Issue of Research and Review Journal of Nondestructive Testing (ReJNDT) ISSN 2941-4989 | Vol. 1(1)Participation on discussion🔗
Dethof, F. & Kessler, S.2024Design of Concrete Mock-Ups with Complex Defect Scenarios Using Numerical SimulationsJ Nondestruct Eval Vol. 43, art. 59 (2024), SpringerJournal article🔗
Dickmann, M., Helm, R., Egger, W., Mitteneder J., Duffek, J. A., Jarmatz, P. & Dollinger, G.2025Ab Initio Calculations of Positron Lifetimes in Diamond: The Bulk, Vacancies and Grain BoundaryTrans Tech Publications Ltd, Solid State Phenomena Vol. 374, pp. 145-153, Trans Tech Publications LtdePaper🔗
Duffek, J. A., Bechelaoui, I., Leinen, W. G., Preuß, H., Schlumbohnm, S., Schumann, Y., Dethof, F., Keßler, S., Rathmann, M., Kleinschmidt, J., Kolling, A., Schmidt-Lauff, S., Fink, A., Stiemer, A., Mayr, M. & Neumann, P.2024hpc.bw: an evaluation of short-term performance engineering projectsdtec.bw-Beiträge der Helmut-Schmidt-Universität / Universität der Bundeswehr Hamburg : Forschungsaktivitäten im Zentrum für Digitalisierungs- und Technologieforschung der Bundeswehr dtec.bw : Band 2 – 2024, pp. 223-228, UB HSUBook chapter🔗
Eisentraut, L.2025Deep Learning-Based Detection of Tuberculosis Using a Gaussian Chest X-Ray Image Filter as a Software LensEEE Access, vol. 13, pp. 36065-36081, 2025Journal article🔗
Engel, A., Al-Ketan, O. & Jung, A.2025Multimaterial Approach to Improve the Mechanical Properties of a Novel Modified Auxetic Reentrant Honeycomb StructureAdv. Eng. Mater., 27: 2500332, WileyJournal article🔗
Firmbach, M.2024An approximate block factorization preconditioner for mixed-dimensional beam-solid interactionComputer Methods in Applied Mechanics and Engineering, Volume 431, 2024, 117256, ElsevierJournal article🔗
Firmbach, M., Popp, A. & Mayr, M.2023Computational challenges in mixed-dimensional beam/solid couplingProc. Appl. Math. Mech., 23: e202200227, WileyJournal article🔗
Fries, M., Motzki, P., Bähre, D. and Jung, A2025A Simulative Evaluation of Triply Periodic Minimal Surface Structures in the Context of Elastocaloric ApplicationsAdv. Eng. Mater., 27: 2500661, WileyJournal article🔗
Geiersbach, C., Suchan, T. & Welker, K.2024Stochastic Augmented Lagrangian Method in Riemannian Shape ManifoldsJ Optim Theory Appl 203, pp. 165–195 (2024)Journal article🔗
Homes, S., Frezzotti, A. & Nitzke, I. H. Struchtrup, J. Vrabec2025Heat and mass transfer across the vapor–liquid interface: A comparison of molecular dynamics and the Enskog–Vlasov kinetic modelInternational Journal of Heat and Mass Transfer, Volume 242, 2025, 126828, ElsevierJournal article🔗
Horn, R. & Neumann, P.2024Towards Green HPC Job Outsourcing: Energy Models for Molecular Dynamics Simulations on Three Clusters2024 23rd International Symposium on Parallel and Distributed Computing (ISPDC), Chur, Switzerland, 2024, IEEEJournal article🔗
HSU & MEGWARE2022Video: HSUper und CBRZhpc.bwVideo🔗
Iberl, A., Trautner, E., Klein, M. & Hasselberger, J.2023Numerical Investigation of Gas Bubble Behavior for Pool Scrubbing in Nuclear Reactors using the Volume-of-Fluid Method19th Multiphase Flow Conference & Short CourseConference Poster🔗
Jafari, V. & Neumann, P.2023Fault Tolerance for Ensemble-based Molecular-Continuum Flow SimulationsProceedings of the International Conference on High Performance Computing in Asia-Pacific Region, pp. 35-45. Association for Computing MachineryBook chapter🔗
Jarmatz, P., Wittenberg H., Jafari, V., Das Sharma, A., Maurer, F., Wittmer, N. & Neumann, P.2022MaMiCo 2.0: An enhanced open-source framework for high-performance molecular-continuum flow simulationSoftwareX, Vol. 20 (2022), 101251Journal article🔗
Jarmatz, P., Lerdo, S. & Neumann, P.2023Convolutional Recurrent Autoencoder for Molecular-Continuum CouplingComputational Science - ISCC 2023, 23rd International Conference Prague, Czech Repupblic, July 3-5, 2023, Proceedings, Part IV, pp. 535–549Book chapter🔗
Jeyaseelan, T., Son, M., Sander, T. & Zigan, L.2023Experimental and Modeling Analysis of the Transient Spray Characteristics of Cyclopentane at Sub- and Transcritical Conditions using a Machine Learning ApproachPhysics of Fluids Vol. 35, Issue 8, 083119 (2023), AIPJournal article🔗
Kandekar, C., Ravikumar, A., Höche, D. & Weber, W.E.2023A partitioned computational framework for damage evolution in stress corrosion cracking utilizing phase-fieldProceedings in Applied Mathematics and Mechanics Vol. 22, Issue 1 e202200211, PAMMJournal article🔗
Kasischke, K. & Oertel, M.2025Turbulent Profiles of Flows on a Block Ramp via Numerical CFD SimulationsBook of Extended Abstracts of the 41st IAHR World Congress (Singapore, 2025), IAHRConference Paper🔗
Keßler, S.2024Application of the German Standardization Approach for the Reliability Assessment of NDT – Honeycomb Detection in Concrete using Ultrasonic TestingJournal of Advanced Concrete Technology, 2024, Volume 22, Issue 10, pp. 664-673Journal article🔗
Khalifa, A. & Breuer, M.2024Evaluation of an efficient data-driven ANN model to predict agglomerate collisions within Euler-Lagrange simulationsComputers and Fluids Vol. 269 (2024), 106119, ElsevierJournal article🔗
Khalifa, A. & Breuer, M.2025Investigation of cohesive particle deagglomeration in homogeneous isotropic turbulence using particle-resolved direct numerical simulationPhysics of Fluids Vol. 37 (2025), 083339, AIP PublishingJournal article🔗
Khalifa, A. & Breuer, M.2023Data-driven ANN approach for binary agglomerate collisions including breakage and agglomerationChemical Engineering Research and Design Vol. 195 (2023), pp. 14–27, ElsevierJournal article🔗
Kim, H.; Deng, M., Fortuin, A., Würger, T., Georgopanos, P., Kramer, D., Zheludkevich, M. & Höche, D.2024Influence of Simple Salts on Solvent Reduction Stability at Mg-Alloy Anodes Interface: A Potential-Dependent DFT StudyAdv. Energy Mater. 2024, 14, 2401266, WileyJournal article🔗
König, L., Zitzmann, S., Fütterer, T., Campos, D. G., Scherer, R. & Hecht, M.2024An Evaluation of the Performance of Stopping Rules in AI-assisted Reviewing for Psychological Meta-Analytical ResearchPreprint. Research Synthesis Methods, OSFJournal article🔗
König, L., Zitzmann, S., Fütterer, T., Campos, D.G., Scherer, R. & Hecht, M.2024An evaluation of the performance of stopping rules in AI-aided screening for psychological meta-analytical researchResearch Synthesis Methods Vol. 15, Issue 6. pp. 1120-1146, WileyJournal article🔗
Kozakov, R., Maigler, M., Schein, J. & Wallace, N.2024Determination of Self-Neutralization Phenomena of Ion Beams with Langmuir Probe Measurement and PIC-DSMC SimulationsApplied Sciences 14 (2024, Issue 8, 3740, MDPIJournal article🔗
Lange, C.2023Reaktive Strukturmaterialien – Interdisziplinäre und multiskalige Grundlagenforschung in Experiment und SimulationWehrwissenschaftliche Forschung, Jahresbericht 2022, pp.60-61, BMVgReport🔗
Maigler, M., Pessina, V. & Schein, J.2024Predicting Lift and Drag Coefficients during Hypersonics Mars Reentry using hyStrathPhysics of Fluids Vol. 36 (2024), 046105, AIPJournal article🔗
Margenberg, N., Anselmann, M., Bause, M., Jendersie, R., Lessig, C. & Richter, T.2025Benchmark of hybrid finite element/deep neural network methodsSequeira, A. et al. (eds.), Numerical Mathematics and Advanced Applications ENUMATH 2023, Volume 2, Lect. Notes Comput. Sci. Eng., pp. 119-138, SpringerBook chapter🔗
Margenberg, N., Kärtner, F.X. & Bause, M.2024Optimal Dirichlet Boundary Control by Fourier Neural Operators Applied to Nonlinear OpticsJournal of Computational Physics, Volume 499, 2024, 112725, ElsevierJournal article🔗
Mercer, M. P., Bhandari, A., Peng, Chao, Dziedzic, J., Skylaris, C. K. & Kramer, Denis2024Tuning the work function of graphite nanoparticles via edge terminationPhys. Chem. Chem. Phys., 2024,26, 16175-16183, Royal Society of ChemistryJournal article🔗
Neumann, L., Wittenberg, P., Mendler, A. & Gertheiss, J.2024Confounder-adjusted Covariances of System Outputs and Applications to Structural Health MonitoringElsevierJournal article🔗
Bause, M., Breuer, M., Kramer, D., Neumann, P. & Rathmann, M.2022-2025Newsletter hpc.bwSchriftenreihe des dtec.bw Projektes hpc.bw, UB HSUPublished project report🔗
Neumann, P., Das Sharma, A., Viot, L., Trummler, T., Doehring, A., Son, M., Sander, T., Pfitzner, M., Zigan, L., Klein, M., Gratl, F., Newcome, S., Bungartz, H.-J., Nitzke, I., Homes, S., Vrabec, J., Stierle, R., Gross, J., Auweter, A. & Tippmann, N.2022MaST: Scale-Bridging Exploration of Transcritical Fluid Systemsdtec.bw-Beiträge der Helmut-Schmidt-Universität / Universität der Bundeswehr Hamburg. Forschungsaktivitäten im Zentrum für Digitalisierungs- und Technologieforschung der Bundeswehr dtec.bw : Band 1, 2022, pp. 101-106, UB HSUBook chapter🔗
Neumann, P., Duffek, J. A., Kleinschmidt, J., Leinen, W. G., Breuer, M., Schmidt-Lauff, S., Fink, A., Mayr, M., Firmbach, M., Popp, A. & Auweter, A.2022hpc.bw: A Supercomputer with Competence Platform for the Universities of the Federal Armed Forcesdtec.bw-Beiträge der Helmut-Schmidt-Universität / Universität der Bundeswehr Hamburg. Forschungsaktivitäten im Zentrum für Digitalisierungs- und Technologieforschung der Bundeswehr dtec.bw : Band 1, 2022, pp. 305-310, UB HSUBook chapter🔗
Nitzke, I., Stephan, S. & Vrabec, J.2024Topology of thermodynamic potentials using physical models: Helmholtz, Gibbs, Grand, and NullAmerican Institute of PhysicsJournal article🔗
Palani, A., Kandekar, C., Breuer, M. & Weber, W. E.2023Toward coupled fire-structure simulations for forecasting smoke leakage in case of concrete structures under fireProceedings in Applied Mathematics and Mechanics, 23, e202300250, WileyJournal article🔗
Peravali, S. K., Jafari, V., Samanta, A. K., Küpper, J., Amin, M., Neumann, P. & Breuer, M.2024Accuracy and Performance Evaluation of Low Density Internal and External Flow Predictions using CFD and DSMCComputers and Fluids, Vol. 279 (2024), 106346Journal article🔗
Peravali, S. K., Samanta, A., Amin, M., Neumann, P., Küpper, J. & Breuer, M.2025An improved simulation methodology for nanoparticle injection through aerodynamic lens systemsPhysics of Fluids Vol. 37 (2025), 033380, AIP PublishingJournal article🔗
Pinzon Escobar, J. A.; Hocks, A.; Neumann, P.2025Node-level Performance of Adaptive Resolution in ls1 mardynPaszynski, M., Barnard, A.S., Zhang, Y.J. (eds) Computational Science – ICCS 2025 Workshops. ICCS 2025. Lecture Notes in Computer Science, vol 15911. Springer, Cham.Conference Paper🔗
Preuß, H., De Nayer, G., Das Sharma, A., Jarmatz, P., Leinen, W., Jafari, V., Horn, R., Breuer, M., Fink, A. & Neumann, P.2024hpc.bw Benchmark Report 2022-2024UB HSUBook chapter🔗
Prifling, B., Fuchs, L., Yessim, A., Osenberg, M., Paulisch-Rinke, M., Zimmer, Ph., Hager, M. D., Schubert, U. S., Manke, I., Carraro, M. & Schmidt, V.2024Correlating the 3D Morphology of Polymer-Based Battery Electrodes with Effective Transport PropertiesACS Applied Materials & Interfaces Vol. 16, Issue 48, American Chemical SocietyJournal article🔗
Rieck, C., Mai, C., Eisentraut, L. & Buettner, R.2025A Novel Transformer-CNN Hybrid Deep Learning Architecture for Robust Broad-Coverage Diagnosis of Eye Diseases on Color Fundus ImagesIEEE Access, vol. 13, pp. 156285-156300, 2025Journal article🔗
Rottmann, M., Kandekar, C. & Weber, W. E.2025An approach for a novel multiscale partitioned framework for predicting collapse of buildings under fire loadsProceedings of the 12th International Conference on Fracture Mechanics for Concrete and Concrete StructuresBook chapter🔗
Sannino, A., Pessina, V., Savino, R. & Schein, J.2025Design and Performances of Intake for Atmosphere-Breathing Electric Propulsion Systems with Direct Simulation Monte Carlo MethodPhysics of Fluids Vol. 37, 027189, AIP PublishingJournal article🔗
Schumann, Y., Dottermusch, M., Schweizer, L., Krech, M., Lempertz, T., Schüller, U., Neumann, P. & Neumann, J. E.2024Morphology-Based Molecular Classification of Spinal Cord Ependymomas Using a Deep Neural NetworksBrain Pathology. 2024; 34(5):e13239, WileyJournal article🔗
Silva, A.,Cao, J., Polcar, T. & Kramer, D.2022Design Guidelines for Two-Dimensional Transition Metal Dichalcogenide AlloysChemistry of Materials Vol. 34, Issue 23 (2022), pp. 10279-10290, ACSJournal article🔗
Silva, A., Cao, J., Polcar, T. & Kramer, D.2022Pettifor maps of complex ternary two-dimensional transition metal sulfidesnpj Comput Mater 8, 178 (2022), Springer-NatureJournal article🔗
Son, M., Sander, T., Pfitzner, M., Zigan, L., Doehring, A. & Klein, M.2025Experimental and Numerical Investigation of Cyclopentane Sprays in Transcritical EnvironmentAtomization and Sprays Vol. 35, Issue 4, Begell HouseJournal article🔗
Son, M., Zigan, L., Pfitzner, M. & Sander, T.2025Deconvolution of Infrared Spray Images using Optical Depth from Shadowgraphy12th European Combustion Meeting, 7–10 April 2025, Edinburgh, ScotlandConference Paper🔗
Suchan, T., Kandekar, C., Weber, W. E. & Welker, K.2024Crack propagation in anisotropic brittle materials: From a phase-field model to a shape optimization approachEngineering Fracture Mechanics Vol. 303 (2024=, 110065, ElsevierJournal article🔗
Teh, T. W., Franz, P., Stierle, R., Hansen, N. & Gross, J.2025Classical density functional theory for alkane adsorption in cationic Faujasites: comparison with grand canonical Monte Carlo simulationsMolecular Physics, Art. e2471510, Taylor & FrancisJournal article🔗
Trautner, E., Hasslberger, J. & Klein, M.2023Towards LES of liquid jet atomization using an Eulerian-Lagrangian multiscale approachFlow Turbulence Combust Vol. 115 (2024), 243-273Book chapter🔗
Viot, L., Piel, Y. & Neumann, P.2023From Desktop to Supercomputer: Computational Fluid Dynamics Augmented by Molecular Dynamics using MaMiCo and preCICEBienz, A., Weiland, M., Baboulin, M., Kruse, C. (eds) High Performance Computing. ISC High Performance 2023. Lecture Notes in Computer Science, vol 13999. Springer, Cham, pp. 567–576, SpringerConference Paper🔗
Weber, W., Kandekar, C., Rottmann, M., Breuer, M., Palani, A., Niggemann, O. & Liebert, A.2023Increasing the safety of rescue workers in fire events by merging fire simulations, structural models, and artificial intelligencedtec.bw-Beiträge der Helmut-Schmidt-Universität / Universität der Bundeswehr Hamburg : Forschungsaktivitäten im Zentrum für Digitalisierungs- und Technologieforschung der Bundeswehr dtec.bw : Band 1, 2022, pp. 209-215Book chapter🔗
Wehrmann, V. S., Chakraborty, N., Klein, M. & Hasslberger, J.2024Choice of reaction progress variable under preferential diffusion effects in turbulent syngas combustion based on detailed chemistry direct numerical simulationsSci Rep 14, 14861 (2024), Springer NatureJournal article🔗
Wehrmann, V. S.;, N.; Klein, M. & Hasslberger, J.2024Choice of reaction progress variable under preferential diffusion effects in turbulent syngas combustion based on detailed chemistry direct numerical simulationsSci Rep 14, 14861 (2024), Springer NatureJournal article🔗
Wiedemann, M.; Penava, P.; Mai, C.; Buettner, R.2025Deep-Learning-based Determination of Textile Properties: A Novel Triplet Architecture Approach for Classifying Cotton ContentIEEE Access, vol. 13, pp. 164395-164408Journal article🔗