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587 Publications
2026 | Conference Paper | LibreCat-ID: 63890
@inproceedings{Stachura_Wu_Plessl_Fang_2026, place={New York, NY, USA}, title={SORCERI: Streaming Overlay Acceleration for Highly Contracted Electron Repulsion Integral Computations in Quantum Chemistry}, DOI={10.1145/3748173.3779198}, booktitle={Proceedings of the 2026 ACM/SIGDA International Symposium on Field Programmable Gate Arrays (FPGA ’26)}, publisher={Association for Computing Machinery}, author={Stachura, Philip and Wu, Xin and Plessl, Christian and Fang, Zhenman}, year={2026}, pages={224–234} }
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2026 | Conference Paper | LibreCat-ID: 65101
@inproceedings{Tareen_Plessl_Kenter_2026, title={Fast Multi-Tau Correlators on FPGA with Context Switching From and to High- Bandwidth Memory}, DOI={10.1109/icfpt67023.2025.00027}, booktitle={2025 International Conference on Field Programmable Technology (ICFPT)}, publisher={IEEE}, author={Tareen, Abdul Rehman and Plessl, Christian and Kenter, Tobias}, year={2026} }
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2026 | Journal Article | LibreCat-ID: 65629
@article{Iannuzzi_Wilhelm_Stein_Bussy_Elgabarty_Golze_Hehn_Graml_Marek_Gökmen_et al._2026, title={The CP2K Program Package Made Simple}, volume={130}, DOI={10.1021/acs.jpcb.5c05851}, number={4}, journal={The Journal of Physical Chemistry B}, publisher={American Chemical Society (ACS)}, author={Iannuzzi, Marcella and Wilhelm, Jan and Stein, Frederick and Bussy, Augustin and Elgabarty, Hossam and Golze, Dorothea and Hehn, Anna-Sophia and Graml, Maximilian and Marek, Stepan and Gökmen, Beliz Sertcan and et al.}, year={2026}, pages={1237–1310} }
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2025 | Preprint | LibreCat-ID: 64071
@article{Wu_Elgabarty_Alizadeh_Henao Aristizabal_Zysk_Plessl_Ehlert_Hutter_Kühne_2025, title={Benchmarking semi-empirical quantum chemical methods on liquid water}, author={Wu, Xin and Elgabarty, Hossam and Alizadeh, Vahideh and Henao Aristizabal, Andres and Zysk, Frederik and Plessl, Christian and Ehlert, Sebastian and Hutter, Jürg and Kühne, Thomas D.}, year={2025} }
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2025 | Journal Article | LibreCat-ID: 61246
@article{Köcher_Rose_Bharadwaj_Schumacher_Schumacher_2025, title={Numerical solution of nonlinear Schrödinger equation by a hybrid pseudospectral-variational quantum algorithm}, volume={15}, DOI={10.1038/s41598-025-05660-3}, number={123478}, journal={Scientific Reports}, publisher={Springer Science and Business Media LLC}, author={Köcher, Nikolas and Rose, Hendrik and Bharadwaj, Sachin S. and Schumacher, Jörg and Schumacher, Stefan}, year={2025} }
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2025 | Journal Article | LibreCat-ID: 61249
@article{Ai_Wingenbach_Yang_Wei_Hatzopoulos_Savvidis_Schumacher_Ma_Gao_2025, title={Optically and remotely controlling localization of exciton-polariton condensates in a potential lattice}, volume={23}, DOI={10.1103/physrevapplied.23.024029}, number={2024029}, journal={Physical Review Applied}, publisher={American Physical Society (APS)}, author={Ai, Qiang and Wingenbach, Jan and Yang, Xinmiao and Wei, Jing and Hatzopoulos, Zaharias and Savvidis, Pavlos G. and Schumacher, Stefan and Ma, Xuekai and Gao, Tingge}, year={2025} }
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2025 | Journal Article | LibreCat-ID: 61351
@article{Diederich_Paszuk_Ruiz Alvarado_Krenz_Zare Pour_Babu_Velazquez Rojas_Höhn_Gao_Schwarzburg_et al._2025, title={Ultrafast Electron Dynamics at the Water‐Modified InP(100) Surface}, volume={12}, DOI={10.1002/admi.202500463}, number={16e00463}, journal={Advanced Materials Interfaces}, publisher={Wiley}, author={Diederich, Jonathan and Paszuk, Agnieszka and Ruiz Alvarado, Isaac Azahel and Krenz, Marvin and Zare Pour, Mohammad Amin and Babu, Diwakar Suresh and Velazquez Rojas, Jennifer and Höhn, Christian and Gao, Yuying and Schwarzburg, Klaus and et al.}, year={2025} }
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2025 | Journal Article | LibreCat-ID: 61356
@article{Biktagirov_Gerstmann_Schmidt_2025, title={Topological defects in semiconducting carbon nanotubes as triplet exciton traps and single-photon emitters}, volume={17}, DOI={10.1039/d4nr03904a}, number={11}, journal={Nanoscale}, publisher={Royal Society of Chemistry (RSC)}, author={Biktagirov, Timur and Gerstmann, Uwe and Schmidt, Wolf Gero}, year={2025}, pages={6884–6891} }
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2025 | Journal Article | LibreCat-ID: 58519
@article{Kopylov_Meier_Sharapova_2025, title={Theory of Multimode Squeezed Light Generation in Lossy Media}, volume={9}, DOI={10.22331/q-2025-02-04-1621}, number={1621}, journal={Quantum}, publisher={Verein zur Forderung des Open Access Publizierens in den Quantenwissenschaften}, author={Kopylov, Denis A. and Meier, Torsten and Sharapova, Polina R.}, year={2025} }
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2025 | Journal Article | LibreCat-ID: 62034
@article{Katbashev_Schade_Laß_Müller_Grimme_Hansen_Kühne_2025, title={Submatrix and GPU-accelerated implementation of density matrix tight-binding}, volume={163}, DOI={10.1063/5.0271379}, number={13132501}, journal={The Journal of Chemical Physics}, publisher={AIP Publishing}, author={Katbashev, Abylay and Schade, Robert and Laß, Michael and Müller, Marcel and Grimme, Stefan and Hansen, Andreas and Kühne, Thomas}, year={2025} }
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2025 | Journal Article | LibreCat-ID: 62064 | 
@article{Büttner_Alt_Kenter_Köstler_Plessl_Aizinger_2025, title={Analyzing performance portability for a SYCL implementation of the 2D shallow water equations}, volume={81}, DOI={10.1007/s11227-025-07063-7}, number={6772}, journal={The Journal of Supercomputing}, publisher={Springer Science and Business Media LLC}, author={Büttner, Markus and Alt, Christoph and Kenter, Tobias and Köstler, Harald and Plessl, Christian and Aizinger, Vadym}, year={2025} }
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2025 | Conference Paper | LibreCat-ID: 62066 |
@inproceedings{Alt_Plessl_Kenter_2025, place={New York, NY, USA}, series={IWOCL ’25}, title={Evaluating oneAPI I/O Pipes in a Case Study of Scaling a SYCL Jacobi Solver to multiple FPGAs}, DOI={10.1145/3731125.3731131}, booktitle={Proceedings of the 13th International Workshop on OpenCL and SYCL}, publisher={Association for Computing Machinery}, author={Alt, Christoph and Plessl, Christian and Kenter, Tobias}, year={2025}, collection={IWOCL ’25} }
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2025 | Conference Paper | LibreCat-ID: 62065
@inproceedings{Sundriyal_Büttner_Alt_Kenter_Aizinger_2025, title={Adaptive Spectral Block Floating Point for Discontinuous Galerkin Methods}, DOI={10.1109/hpec67600.2025.11196195}, booktitle={2025 IEEE High Performance Extreme Computing Conference (HPEC)}, publisher={IEEE}, author={Sundriyal, Shivam and Büttner, Markus and Alt, Christoph and Kenter, Tobias and Aizinger, Vadym}, year={2025} }
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2025 | Journal Article | LibreCat-ID: 62862
@article{Ai_Ma_Barkhausen_Zhai_Xing_Yang_Wang_Liu_Zhang_Gu_et al._2025, title={Tuning polariton vortices in an asymmetric ring potential}, volume={127}, DOI={10.1063/5.0287076}, number={12121103}, journal={Applied Physics Letters}, publisher={AIP Publishing}, author={Ai, Qiang and Ma, Xuekai and Barkhausen, Franziska and Zhai, Xiaokun and Xing, Chunzi and Yang, Xinmiao and Wang, Peilin and Liu, Tianyu and Zhang, Yong and Gu, Yazhou and et al.}, year={2025} }
LibreCat
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2025 | Journal Article | LibreCat-ID: 60568 |
@article{Bocchini_Kollmann_Gerstmann_Schmidt_Grundmeier_2025, title={Phosphonic acid adsorption on <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si23.svg" display="inline" id="d1e564"><mml:mi>α</mml:mi></mml:math>-Bi<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si24.svg" display="inline" id="d1e569"><mml:msub><mml:mrow/><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub></mml:math>O<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si25.svg" display="inline" id="d1e577"><mml:msub><mml:mrow/><mml:mrow><mml:mn>3</mml:mn></mml:mrow></mml:msub></mml:math> surfaces}, volume={760}, DOI={10.1016/j.susc.2025.122776}, number={122776}, journal={Surface Science}, publisher={Elsevier BV}, author={Bocchini, Adriana and Kollmann, S. and Gerstmann, Uwe and Schmidt, Wolf Gero and Grundmeier, Guido}, year={2025} }
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2025 | Journal Article | LibreCat-ID: 61353
@article{Franzke_Schmidt_Gerstmann_2025, title={Finite-size and relativistic effects onto hyperfine interaction of muonic hydrogen}, volume={3027}, DOI={10.1088/1742-6596/3027/1/012001}, number={1012001}, journal={Journal of Physics: Conference Series}, publisher={IOP Publishing}, author={Franzke, Katharina L. and Schmidt, Wolf Gero and Gerstmann, Uwe}, year={2025} }
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2025 | Journal Article | LibreCat-ID: 60992
@article{Wingenbach_Ares Santos_Ma_Sperling_Schumacher_2025, title={Sensitivity and Topology of Exceptional Rings in Nonlinear Non-Hermitian Planar Optical Microcavities}, DOI={10.48550/ARXIV.2507.07099}, journal={Arxiv}, publisher={Arxiv}, author={Wingenbach, Jan and Ares Santos, Laura and Ma, Xuekai and Sperling, Jan and Schumacher, Stefan}, year={2025} }
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2025 | Journal Article | LibreCat-ID: 62926
@article{Patra_Konrad_Sperlich_Biktagirov_Schmidt_Spencer_Aharonovich_Höfling_Dyakonov_2025, title={Quantifying Spin Defect Density in hBN via Raman and Photoluminescence Analysis}, DOI={10.1002/adfm.202517851}, number={e17851}, journal={Advanced Functional Materials}, publisher={Wiley}, author={Patra, Atanu and Konrad, Paul and Sperlich, Andreas and Biktagirov, Timur and Schmidt, Wolf Gero and Spencer, Lesley and Aharonovich, Igor and Höfling, Sven and Dyakonov, Vladimir}, year={2025} }
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2025 | Journal Article | LibreCat-ID: 63160
@article{Rose_Schumacher_Meier_2025, title={Microscopic approach to the quantized light-matter interaction in semiconductor nanostructures: Complex coupled dynamics of excitons, biexcitons, and photons}, volume={112}, DOI={10.1103/528f-7smh}, number={24245304}, journal={Physical Review B}, publisher={American Physical Society (APS)}, author={Rose, Hendrik and Schumacher, Stefan and Meier, Torsten}, year={2025} }
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2025 | Journal Article | LibreCat-ID: 60298
@article{Wingenbach_Bauch_Ma_Schade_Plessl_Schumacher_2025, title={PHOENIX – Paderborn highly optimized and energy efficient solver for two-dimensional nonlinear Schrödinger equations with integrated extensions}, volume={315}, DOI={10.1016/j.cpc.2025.109689}, number={109689}, journal={Computer Physics Communications}, publisher={Elsevier BV}, author={Wingenbach, Jan and Bauch, David and Ma, Xuekai and Schade, Robert and Plessl, Christian and Schumacher, Stefan}, year={2025} }
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