Please note that LibreCat no longer supports Internet Explorer versions 8 or 9 (or earlier).
We recommend upgrading to the latest Internet Explorer, Google Chrome, or Firefox.
587 Publications
2026 | Conference Paper | LibreCat-ID: 63890
Stachura, Philip, et al. “SORCERI: Streaming Overlay Acceleration for Highly Contracted Electron Repulsion Integral Computations in Quantum Chemistry.” Proceedings of the 2026 ACM/SIGDA International Symposium on Field Programmable Gate Arrays (FPGA ’26), Association for Computing Machinery, 2026, pp. 224–34, doi:10.1145/3748173.3779198.
LibreCat
| DOI
| Download (ext.)
2026 | Conference Paper | LibreCat-ID: 65101
Tareen, Abdul Rehman, et al. “Fast Multi-Tau Correlators on FPGA with Context Switching From and to High- Bandwidth Memory.” 2025 International Conference on Field Programmable Technology (ICFPT), IEEE, 2026, doi:10.1109/icfpt67023.2025.00027.
LibreCat
| DOI
2026 | Journal Article | LibreCat-ID: 65629
Iannuzzi, Marcella, et al. “The CP2K Program Package Made Simple.” The Journal of Physical Chemistry B, vol. 130, no. 4, American Chemical Society (ACS), 2026, pp. 1237–310, doi:10.1021/acs.jpcb.5c05851.
LibreCat
| DOI
2025 | Preprint | LibreCat-ID: 64071
Wu, Xin, et al. Benchmarking Semi-Empirical Quantum Chemical Methods on Liquid Water. 2025.
LibreCat
| Download (ext.)
2025 | Journal Article | LibreCat-ID: 61246
Köcher, Nikolas, et al. “Numerical Solution of Nonlinear Schrödinger Equation by a Hybrid Pseudospectral-Variational Quantum Algorithm.” Scientific Reports, vol. 15, no. 1, 23478, Springer Science and Business Media LLC, 2025, doi:10.1038/s41598-025-05660-3.
LibreCat
| DOI
2025 | Journal Article | LibreCat-ID: 61249
Ai, Qiang, et al. “Optically and Remotely Controlling Localization of Exciton-Polariton Condensates in a Potential Lattice.” Physical Review Applied, vol. 23, no. 2, 024029, American Physical Society (APS), 2025, doi:10.1103/physrevapplied.23.024029.
LibreCat
| DOI
2025 | Journal Article | LibreCat-ID: 61351
Diederich, Jonathan, et al. “Ultrafast Electron Dynamics at the Water‐Modified InP(100) Surface.” Advanced Materials Interfaces, vol. 12, no. 16, e00463, Wiley, 2025, doi:10.1002/admi.202500463.
LibreCat
| DOI
2025 | Journal Article | LibreCat-ID: 61356
Biktagirov, Timur, et al. “Topological Defects in Semiconducting Carbon Nanotubes as Triplet Exciton Traps and Single-Photon Emitters.” Nanoscale, vol. 17, no. 11, Royal Society of Chemistry (RSC), 2025, pp. 6884–91, doi:10.1039/d4nr03904a.
LibreCat
| DOI
2025 | Journal Article | LibreCat-ID: 58519
Kopylov, Denis A., et al. “Theory of Multimode Squeezed Light Generation in Lossy Media.” Quantum, vol. 9, 1621, Verein zur Forderung des Open Access Publizierens in den Quantenwissenschaften, 2025, doi:10.22331/q-2025-02-04-1621.
LibreCat
| DOI
2025 | Journal Article | LibreCat-ID: 62034
Katbashev, Abylay, et al. “Submatrix and GPU-Accelerated Implementation of Density Matrix Tight-Binding.” The Journal of Chemical Physics, vol. 163, no. 13, 132501, AIP Publishing, 2025, doi:10.1063/5.0271379.
LibreCat
| DOI
2025 | Journal Article | LibreCat-ID: 62064 | 
Büttner, Markus, et al. “Analyzing Performance Portability for a SYCL Implementation of the 2D Shallow Water Equations.” The Journal of Supercomputing, vol. 81, no. 6, 772, Springer Science and Business Media LLC, 2025, doi:10.1007/s11227-025-07063-7.
LibreCat
| DOI
| Download (ext.)
2025 | Conference Paper | LibreCat-ID: 62066 |
Alt, Christoph, et al. “Evaluating OneAPI I/O Pipes in a Case Study of Scaling a SYCL Jacobi Solver to Multiple FPGAs.” Proceedings of the 13th International Workshop on OpenCL and SYCL, Association for Computing Machinery, 2025, doi:10.1145/3731125.3731131.
LibreCat
| DOI
| Download (ext.)
2025 | Conference Paper | LibreCat-ID: 62065
Sundriyal, Shivam, et al. “Adaptive Spectral Block Floating Point for Discontinuous Galerkin Methods.” 2025 IEEE High Performance Extreme Computing Conference (HPEC), IEEE, 2025, doi:10.1109/hpec67600.2025.11196195.
LibreCat
| DOI
2025 | Journal Article | LibreCat-ID: 62862
Ai, Qiang, et al. “Tuning Polariton Vortices in an Asymmetric Ring Potential.” Applied Physics Letters, vol. 127, no. 12, 121103, AIP Publishing, 2025, doi:10.1063/5.0287076.
LibreCat
| DOI
2025 | Journal Article | LibreCat-ID: 60568 |
Bocchini, Adriana, et al. “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.” Surface Science, vol. 760, 122776, Elsevier BV, 2025, doi:10.1016/j.susc.2025.122776.
LibreCat
| DOI
| Download (ext.)
2025 | Journal Article | LibreCat-ID: 61353
Franzke, Katharina L., et al. “Finite-Size and Relativistic Effects onto Hyperfine Interaction of Muonic Hydrogen.” Journal of Physics: Conference Series, vol. 3027, no. 1, 012001, IOP Publishing, 2025, doi:10.1088/1742-6596/3027/1/012001.
LibreCat
| DOI
2025 | Journal Article | LibreCat-ID: 60992
Wingenbach, Jan, et al. “Sensitivity and Topology of Exceptional Rings in Nonlinear Non-Hermitian Planar Optical Microcavities.” Arxiv, Arxiv, 2025, doi:10.48550/ARXIV.2507.07099.
LibreCat
| DOI
2025 | Journal Article | LibreCat-ID: 62926
Patra, Atanu, et al. “Quantifying Spin Defect Density in HBN via Raman and Photoluminescence Analysis.” Advanced Functional Materials, e17851, Wiley, 2025, doi:10.1002/adfm.202517851.
LibreCat
| DOI
2025 | Journal Article | LibreCat-ID: 63160
Rose, Hendrik, et al. “Microscopic Approach to the Quantized Light-Matter Interaction in Semiconductor Nanostructures: Complex Coupled Dynamics of Excitons, Biexcitons, and Photons.” Physical Review B, vol. 112, no. 24, 245304, American Physical Society (APS), 2025, doi:10.1103/528f-7smh.
LibreCat
| DOI
2025 | Journal Article | LibreCat-ID: 60298
Wingenbach, Jan, et al. “PHOENIX – Paderborn Highly Optimized and Energy Efficient Solver for Two-Dimensional Nonlinear Schrödinger Equations with Integrated Extensions.” Computer Physics Communications, vol. 315, 109689, Elsevier BV, 2025, doi:10.1016/j.cpc.2025.109689.
LibreCat
| DOI