7 Publications
2026 | Conference Paper | LibreCat-ID: 63890
Stachura, Philip, Xin Wu, Christian Plessl, and Zhenman Fang. “SORCERI: Streaming Overlay Acceleration for Highly Contracted Electron Repulsion Integral Computations in Quantum Chemistry.” In Proceedings of the 2026 ACM/SIGDA International Symposium on Field Programmable Gate Arrays (FPGA ’26), 224–34. New York, NY, USA: Association for Computing Machinery, 2026. https://doi.org/10.1145/3748173.3779198.
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2026 | Journal Article | LibreCat-ID: 66553 | 
Wu, Xin, Hossam Elgabarty, Vahideh Alizadeh, Andrés Henao, Frederik Zysk, Christian Plessl, Sebastian Ehlert, Jürg Hutter, and Thomas D. Kühne. “Benchmarking Semiempirical Quantum Chemical Methods on Liquid Water.” The Journal of Chemical Physics 165, no. 3 (2026). https://doi.org/10.1063/5.0343753.
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2025 | Preprint | LibreCat-ID: 64071
Wu, Xin, Hossam Elgabarty, Vahideh Alizadeh, Andres Henao Aristizabal, Frederik Zysk, Christian Plessl, Sebastian Ehlert, Jürg Hutter, and Thomas D. Kühne. “Benchmarking Semi-Empirical Quantum Chemical Methods on Liquid Water,” 2025.
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2025 | Report | LibreCat-ID: 62981 |
Ehtesabi, Sadaf, Manoar Hossain, Tobias Kenter, Andreas Krawinkel, Lukas Ostermann, Christian Plessl, Heinrich Riebler, et al. Otus Supercomputer. Vol. 1. PC2 Technical Report Series. Paderborn: Paderborn Center for Parallel Computing (PC2), 2025. https://doi.org/10.48550/ARXIV.2512.07401.
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2024 | Journal Article | LibreCat-ID: 53663 |
Bauer, Carsten, Tobias Kenter, Michael Lass, Lukas Mazur, Marius Meyer, Holger Nitsche, Heinrich Riebler, et al. “Noctua 2 Supercomputer.” Journal of Large-Scale Research Facilities 9 (2024). https://doi.org/10.17815/jlsrf-8-187 .
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2024 | Conference Paper | LibreCat-ID: 56609
Stachura, Philip, Guanyu Li, Xin Wu, Christian Plessl, and Zhenman Fang. “SERI: High-Throughput Streaming Acceleration of Electron Repulsion Integral Computation in Quantum Chemistry Using HBM-Based FPGAs.” In 2024 34th International Conference on Field-Programmable Logic and Applications (FPL), 60–68. IEEE, 2024. https://doi.org/10.1109/fpl64840.2024.00018.
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2023 | Conference Paper | LibreCat-ID: 43228
Wu, Xin, Tobias Kenter, Robert Schade, Thomas Kühne, and Christian Plessl. “Computing and Compressing Electron Repulsion Integrals on FPGAs.” In 2023 IEEE 31st Annual International Symposium on Field-Programmable Custom Computing Machines (FCCM), 162–73, 2023. https://doi.org/10.1109/FCCM57271.2023.00026.
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7 Publications
2026 | Conference Paper | LibreCat-ID: 63890
Stachura, Philip, Xin Wu, Christian Plessl, and Zhenman Fang. “SORCERI: Streaming Overlay Acceleration for Highly Contracted Electron Repulsion Integral Computations in Quantum Chemistry.” In Proceedings of the 2026 ACM/SIGDA International Symposium on Field Programmable Gate Arrays (FPGA ’26), 224–34. New York, NY, USA: Association for Computing Machinery, 2026. https://doi.org/10.1145/3748173.3779198.
LibreCat
| DOI
| Download (ext.)
2026 | Journal Article | LibreCat-ID: 66553 |
Wu, Xin, Hossam Elgabarty, Vahideh Alizadeh, Andrés Henao, Frederik Zysk, Christian Plessl, Sebastian Ehlert, Jürg Hutter, and Thomas D. Kühne. “Benchmarking Semiempirical Quantum Chemical Methods on Liquid Water.” The Journal of Chemical Physics 165, no. 3 (2026). https://doi.org/10.1063/5.0343753.
LibreCat
| DOI
| Download (ext.)
2025 | Preprint | LibreCat-ID: 64071
Wu, Xin, Hossam Elgabarty, Vahideh Alizadeh, Andres Henao Aristizabal, Frederik Zysk, Christian Plessl, Sebastian Ehlert, Jürg Hutter, and Thomas D. Kühne. “Benchmarking Semi-Empirical Quantum Chemical Methods on Liquid Water,” 2025.
LibreCat
| Download (ext.)
2025 | Report | LibreCat-ID: 62981 |
Ehtesabi, Sadaf, Manoar Hossain, Tobias Kenter, Andreas Krawinkel, Lukas Ostermann, Christian Plessl, Heinrich Riebler, et al. Otus Supercomputer. Vol. 1. PC2 Technical Report Series. Paderborn: Paderborn Center for Parallel Computing (PC2), 2025. https://doi.org/10.48550/ARXIV.2512.07401.
LibreCat
| Files available
| DOI
2024 | Journal Article | LibreCat-ID: 53663 |
Bauer, Carsten, Tobias Kenter, Michael Lass, Lukas Mazur, Marius Meyer, Holger Nitsche, Heinrich Riebler, et al. “Noctua 2 Supercomputer.” Journal of Large-Scale Research Facilities 9 (2024). https://doi.org/10.17815/jlsrf-8-187 .
LibreCat
| Files available
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2024 | Conference Paper | LibreCat-ID: 56609
Stachura, Philip, Guanyu Li, Xin Wu, Christian Plessl, and Zhenman Fang. “SERI: High-Throughput Streaming Acceleration of Electron Repulsion Integral Computation in Quantum Chemistry Using HBM-Based FPGAs.” In 2024 34th International Conference on Field-Programmable Logic and Applications (FPL), 60–68. IEEE, 2024. https://doi.org/10.1109/fpl64840.2024.00018.
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| Download (ext.)
2023 | Conference Paper | LibreCat-ID: 43228
Wu, Xin, Tobias Kenter, Robert Schade, Thomas Kühne, and Christian Plessl. “Computing and Compressing Electron Repulsion Integrals on FPGAs.” In 2023 IEEE 31st Annual International Symposium on Field-Programmable Custom Computing Machines (FCCM), 162–73, 2023. https://doi.org/10.1109/FCCM57271.2023.00026.
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