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148 Publications


2024 | Journal Article | LibreCat-ID: 53474
Characterizing Microheterogeneity in Liquid Mixtures via Local Density Fluctuations
M. Lass, T. Kenter, C. Plessl, M. Brehm, Entropy 26 (2024).
LibreCat | DOI
 

2024 | Conference Paper | LibreCat-ID: 54312
Enabling Performance Portability for Shallow Water Equations on CPUs, GPUs, and FPGAs with SYCL
M. Büttner, C. Alt, T. Kenter, H. Köstler, C. Plessl, V. Aizinger, in: Proceedings of the Platform for Advanced Scientific Computing Conference (PASC), ACM, 2024.
LibreCat | DOI
 

2024 | Journal Article | LibreCat-ID: 53663 | OA
Noctua 2 Supercomputer
C. Bauer, T. Kenter, M. Lass, L. Mazur, M. Meyer, H. Nitsche, H. Riebler, R. Schade, M. Schwarz, N. Winnwa, A. Wiens, X. Wu, C. Plessl, J. Simon, Journal of Large-Scale Research Facilities 9 (2024).
LibreCat | Files available | DOI
 

2024 | Conference Paper | LibreCat-ID: 53503
Optimisation and Evaluation of Breadth First Search with oneAPI/SYCL on Intel FPGAs: from Describing Algorithms to Describing Architectures
K. Olgu, T. Kenter, J. Nunez-Yanez, S. Mcintosh-Smith, in: Proceedings of the 12th International Workshop on OpenCL and SYCL, ACM, 2024.
LibreCat | DOI
 

2023 | Preprint | LibreCat-ID: 43439
A computation of D(9) using FPGA Supercomputing
L. Van Hirtum, P. De Causmaecker, J. Goemaere, T. Kenter, H. Riebler, M. Lass, C. Plessl, ArXiv:2304.03039 (2023).
LibreCat | arXiv
 

2023 | Journal Article | LibreCat-ID: 45361 | OA
Breaking the exascale barrier for the electronic structure problem in ab-initio molecular dynamics
R. Schade, T. Kenter, H. Elgabarty, M. Lass, T. Kühne, C. Plessl, The International Journal of High Performance Computing Applications (2023).
LibreCat | DOI | Download (ext.)
 

2023 | Book Chapter | LibreCat-ID: 45893 | OA
Compute Centers I: Heterogeneous Execution Environments
T. Hansmeier, T. Kenter, M. Meyer, H. Riebler, M. Platzner, C. Plessl, in: C.-J. Haake, F. Meyer auf der Heide, M. Platzner, H. Wachsmuth, H. Wehrheim (Eds.), On-The-Fly Computing -- Individualized IT-Services in Dynamic Markets, Heinz Nixdorf Institut, Universität Paderborn, Paderborn, 2023, pp. 165–182.
LibreCat | Files available | DOI
 

2023 | Conference Paper | LibreCat-ID: 43228
Computing and Compressing Electron Repulsion Integrals on FPGAs
X. Wu, T. Kenter, R. Schade, T. Kühne, C. Plessl, in: 2023 IEEE 31st Annual International Symposium on Field-Programmable Custom Computing Machines (FCCM), 2023, pp. 162–173.
LibreCat | DOI | Download (ext.) | arXiv
 

2023 | Conference Paper | LibreCat-ID: 46189
FPGA Acceleration for HPC Supercapacitor Simulations
C. Prouveur, M. Haefele, T. Kenter, N. Voss, in: Proceedings of the Platform for Advanced Scientific Computing Conference (PASC), ACM, 2023.
LibreCat | Files available | DOI | Download (ext.)
 

2023 | Journal Article | LibreCat-ID: 38041 | OA
Multi-FPGA Designs and Scaling of HPC Challenge Benchmarks via MPI and Circuit-Switched Inter-FPGA Networks
M. Meyer, T. Kenter, C. Plessl, ACM Transactions on Reconfigurable Technology and Systems (2023).
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2023 | Conference Paper | LibreCat-ID: 46190 | OA
Mutation Tree Reconstruction of Tumor Cells on FPGAs Using a Bit-Level Matrix Representation
J.-O. Opdenhövel, C. Plessl, T. Kenter, in: Proceedings of the 13th International Symposium on Highly Efficient Accelerators and Reconfigurable Technologies (HEART), ACM, 2023.
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2023 | Conference Paper | LibreCat-ID: 46188
Scalable Multi-FPGA Design of a Discontinuous Galerkin Shallow-Water Model on Unstructured Meshes
J. Faj, T. Kenter, S. Faghih-Naini, C. Plessl, V. Aizinger, in: Proceedings of the Platform for Advanced Scientific Computing Conference (PASC), ACM, 2023.
LibreCat | Files available | DOI | Download (ext.)
 

2023 | Book Chapter | LibreCat-ID: 46191
Shallow Water DG Simulations on FPGAs: Design and Comparison of a Novel Code Generation Pipeline
C. Alt, T. Kenter, S. Faghih-Naini, J. Faj, J.-O. Opdenhövel, C. Plessl, V. Aizinger, J. Hönig, H. Köstler, in: Lecture Notes in Computer Science, Springer Nature Switzerland, Cham, 2023.
LibreCat | DOI
 

2022 | Conference Paper | LibreCat-ID: 46193 | OA
A High-Fidelity Flow Solver for Unstructured Meshes on Field-Programmable Gate Arrays: Design, Evaluation, and Future Challenges
M. Karp, A. Podobas, T. Kenter, N. Jansson, C. Plessl, P. Schlatter, S. Markidis, in: International Conference on High Performance Computing in Asia-Pacific Region, ACM, 2022.
LibreCat | DOI | Download (ext.)
 

2022 | Dissertation | LibreCat-ID: 32414
Bringing Massive Parallelism and Hardware Acceleration to Linear Scaling Density Functional Theory Through Targeted Approximations
M. Lass, Bringing Massive Parallelism and Hardware Acceleration to Linear Scaling Density Functional Theory Through Targeted Approximations, Universität Paderborn, Paderborn, 2022.
LibreCat | DOI
 

2022 | Preprint | LibreCat-ID: 32404
CP2K on the road to exascale
T. Kühne, C. Plessl, R. Schade, O. Schütt, ArXiv:2205.14741 (2022).
LibreCat | Download (ext.) | arXiv
 

2022 | Journal Article | LibreCat-ID: 27364 LibreCat | DOI
 

2022 | Journal Article | LibreCat-ID: 33226 | OA
Parallel quantum chemistry on noisy intermediate-scale quantum computers
R. Schade, C. Bauer, K. Tamoev, L. Mazur, C. Plessl, T. Kühne, Phys. Rev. Research 4 (2022) 033160.
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2022 | Preprint | LibreCat-ID: 33493
Roadmap on Electronic Structure Codes in the Exascale Era
V. Gavini, S. Baroni, V. Blum, D.R. Bowler, A. Buccheri, J.R. Chelikowsky, S. Das, W. Dawson, P. Delugas, M. Dogan, C. Draxl, G. Galli, L. Genovese, P. Giannozzi, M. Giantomassi, X. Gonze, M. Govoni, A. Gulans, F. Gygi, J.M. Herbert, S. Kokott, T. Kühne, K.-H. Liou, T. Miyazaki, P. Motamarri, A. Nakata, J.E. Pask, C. Plessl, L.E. Ratcliff, R.M. Richard, M. Rossi, R. Schade, M. Scheffler, O. Schütt, P. Suryanarayana, M. Torrent, L. Truflandier, T.L. Windus, Q. Xu, V.W.-Z. Yu, D. Perez, ArXiv:2209.12747 (2022).
LibreCat | arXiv
 

2022 | Journal Article | LibreCat-ID: 33684 | OA
Towards electronic structure-based ab-initio molecular dynamics simulations with hundreds of millions of atoms
R. Schade, T. Kenter, H. Elgabarty, M. Lass, O. Schütt, A. Lazzaro, H. Pabst, S. Mohr, J. Hutter, T. Kühne, C. Plessl, Parallel Computing 111 (2022).
LibreCat | DOI | Download (ext.)
 

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