[{"project":[{"_id":"53","name":"TRR 142: Maßgeschneiderte nichtlineare Photonik: Von grundlegenden Konzepten zu funktionellen Strukturen"},{"name":"TRR 142 - Project Area C","_id":"56"},{"name":"TRR 142 ; TP: C10: Erzeugung und Charakterisierung von Quantenlicht in nichtlinearen Systemen: Eine theoretische Analyse","_id":"174"},{"_id":"52","name":"Computing Resources Provided by the Paderborn Center for Parallel Computing"}],"publication":"High-Order Harmonic Generation in Solids","citation":{"chicago":"Reichelt, Matthias, Ruixin Zuo, Xiaohong Song, Weifeng Yang, and Torsten Meier. “High-Order Harmonic Generation in Semiconductors with Excitonic Effects.” In <i>High-Order Harmonic Generation in Solids</i>. WORLD SCIENTIFIC, 2024. <a href=\"https://doi.org/10.1142/9789811279560_0009\">https://doi.org/10.1142/9789811279560_0009</a>.","short":"M. Reichelt, R. Zuo, X. Song, W. Yang, T. Meier, in: High-Order Harmonic Generation in Solids, WORLD SCIENTIFIC, 2024.","ieee":"M. Reichelt, R. Zuo, X. Song, W. Yang, and T. Meier, “High-Order Harmonic Generation in Semiconductors with Excitonic Effects,” in <i>High-Order Harmonic Generation in Solids</i>, WORLD SCIENTIFIC, 2024.","apa":"Reichelt, M., Zuo, R., Song, X., Yang, W., &#38; Meier, T. (2024). High-Order Harmonic Generation in Semiconductors with Excitonic Effects. In <i>High-Order Harmonic Generation in Solids</i>. WORLD SCIENTIFIC. <a href=\"https://doi.org/10.1142/9789811279560_0009\">https://doi.org/10.1142/9789811279560_0009</a>","bibtex":"@inbook{Reichelt_Zuo_Song_Yang_Meier_2024, title={High-Order Harmonic Generation in Semiconductors with Excitonic Effects}, DOI={<a href=\"https://doi.org/10.1142/9789811279560_0009\">10.1142/9789811279560_0009</a>}, booktitle={High-Order Harmonic Generation in Solids}, publisher={WORLD SCIENTIFIC}, author={Reichelt, Matthias and Zuo, Ruixin and Song, Xiaohong and Yang, Weifeng and Meier, Torsten}, year={2024} }","ama":"Reichelt M, Zuo R, Song X, Yang W, Meier T. High-Order Harmonic Generation in Semiconductors with Excitonic Effects. In: <i>High-Order Harmonic Generation in Solids</i>. WORLD SCIENTIFIC; 2024. doi:<a href=\"https://doi.org/10.1142/9789811279560_0009\">10.1142/9789811279560_0009</a>","mla":"Reichelt, Matthias, et al. “High-Order Harmonic Generation in Semiconductors with Excitonic Effects.” <i>High-Order Harmonic Generation in Solids</i>, WORLD SCIENTIFIC, 2024, doi:<a href=\"https://doi.org/10.1142/9789811279560_0009\">10.1142/9789811279560_0009</a>."},"type":"book_chapter","department":[{"_id":"15"},{"_id":"170"},{"_id":"293"},{"_id":"35"},{"_id":"230"},{"_id":"429"},{"_id":"27"}],"date_created":"2025-12-05T09:44:20Z","publication_status":"published","date_updated":"2025-12-05T09:45:31Z","year":"2024","title":"High-Order Harmonic Generation in Semiconductors with Excitonic Effects","status":"public","author":[{"id":"138","full_name":"Reichelt, Matthias","first_name":"Matthias","last_name":"Reichelt"},{"full_name":"Zuo, Ruixin","first_name":"Ruixin","last_name":"Zuo"},{"full_name":"Song, Xiaohong","first_name":"Xiaohong","last_name":"Song"},{"full_name":"Yang, Weifeng","last_name":"Yang","first_name":"Weifeng"},{"id":"344","full_name":"Meier, Torsten","last_name":"Meier","first_name":"Torsten","orcid":"0000-0001-8864-2072"}],"publication_identifier":{"isbn":["9789811279553","9789811279560"]},"user_id":"16199","doi":"10.1142/9789811279560_0009","_id":"62917","language":[{"iso":"eng"}],"publisher":"WORLD SCIENTIFIC"},{"date_updated":"2025-12-05T09:42:11Z","author":[{"id":"344","first_name":"Torsten","last_name":"Meier","orcid":"0000-0001-8864-2072","full_name":"Meier, Torsten"},{"first_name":"Usman","last_name":"Ali","full_name":"Ali, Usman"},{"full_name":"Holthaus, Martin","last_name":"Holthaus","first_name":"Martin"}],"status":"public","year":"2024","title":"Floquet dynamics of ultracold atoms in optical lattices with a parametrically modulated trapping potential","user_id":"16199","doi":"10.5281/ZENODO.11935146","publisher":"LibreCat University","_id":"62915","project":[{"name":"Computing Resources Provided by the Paderborn Center for Parallel Computing","_id":"52"}],"citation":{"bibtex":"@book{Meier_Ali_Holthaus_2024, title={Floquet dynamics of ultracold atoms in optical lattices with a parametrically modulated trapping potential}, DOI={<a href=\"https://doi.org/10.5281/ZENODO.11935146\">10.5281/ZENODO.11935146</a>}, publisher={LibreCat University}, author={Meier, Torsten and Ali, Usman and Holthaus, Martin}, year={2024} }","chicago":"Meier, Torsten, Usman Ali, and Martin Holthaus. <i>Floquet Dynamics of Ultracold Atoms in Optical Lattices with a Parametrically Modulated Trapping Potential</i>. LibreCat University, 2024. <a href=\"https://doi.org/10.5281/ZENODO.11935146\">https://doi.org/10.5281/ZENODO.11935146</a>.","ama":"Meier T, Ali U, Holthaus M. <i>Floquet Dynamics of Ultracold Atoms in Optical Lattices with a Parametrically Modulated Trapping Potential</i>. LibreCat University; 2024. doi:<a href=\"https://doi.org/10.5281/ZENODO.11935146\">10.5281/ZENODO.11935146</a>","short":"T. Meier, U. Ali, M. Holthaus, Floquet Dynamics of Ultracold Atoms in Optical Lattices with a Parametrically Modulated Trapping Potential, LibreCat University, 2024.","ieee":"T. Meier, U. Ali, and M. Holthaus, <i>Floquet dynamics of ultracold atoms in optical lattices with a parametrically modulated trapping potential</i>. LibreCat University, 2024.","mla":"Meier, Torsten, et al. <i>Floquet Dynamics of Ultracold Atoms in Optical Lattices with a Parametrically Modulated Trapping Potential</i>. LibreCat University, 2024, doi:<a href=\"https://doi.org/10.5281/ZENODO.11935146\">10.5281/ZENODO.11935146</a>.","apa":"Meier, T., Ali, U., &#38; Holthaus, M. (2024). <i>Floquet dynamics of ultracold atoms in optical lattices with a parametrically modulated trapping potential</i>. LibreCat University. <a href=\"https://doi.org/10.5281/ZENODO.11935146\">https://doi.org/10.5281/ZENODO.11935146</a>"},"department":[{"_id":"15"},{"_id":"170"},{"_id":"293"},{"_id":"230"},{"_id":"35"},{"_id":"27"}],"type":"research_data","date_created":"2025-12-05T09:41:14Z"},{"department":[{"_id":"15"},{"_id":"170"},{"_id":"295"},{"_id":"790"},{"_id":"642"},{"_id":"286"},{"_id":"429"},{"_id":"230"},{"_id":"27"},{"_id":"35"},{"_id":"169"}],"type":"journal_article","date_created":"2024-06-24T09:46:25Z","project":[{"_id":"53","name":"TRR 142: TRR 142 - Maßgeschneiderte nichtlineare Photonik: Von grundlegenden Konzepten zu funktionellen Strukturen"},{"name":"TRR 142 - A: TRR 142 - Project Area A","_id":"54"},{"name":"TRR 142 - B: TRR 142 - Project Area B","_id":"55"},{"name":"TRR 142 - A11: TRR 142 - Subproject A11","_id":"166"},{"_id":"168","name":"TRR 142 - B07: TRR 142 - Polaronen-Einfluss auf die optischen Eigenschaften von Lithiumniobat (B07*)"},{"name":"PC2: Computing Resources Provided by the Paderborn Center for Parallel Computing","_id":"52"}],"abstract":[{"text":"<jats:title>Abstract</jats:title><jats:p>Most properties of solid materials are defined by their internal electric field and charge density distributions which so far are difficult to measure with high spatial resolution. Especially for 2D materials, the atomic electric fields influence the optoelectronic properties. In this study, the atomic‐scale electric field and charge density distribution of WSe<jats:sub>2</jats:sub> bi‐ and trilayers are revealed using an emerging microscopy technique, differential phase contrast (DPC) imaging in scanning transmission electron microscopy (STEM). For pristine material, a higher positive charge density located at the selenium atomic columns compared to the tungsten atomic columns is obtained and tentatively explained by a coherent scattering effect. Furthermore, the change in the electric field distribution induced by a missing selenium atomic column is investigated. A characteristic electric field distribution in the vicinity of the defect with locally reduced magnitudes compared to the pristine lattice is observed. This effect is accompanied by a considerable inward relaxation of the surrounding lattice, which according to first principles DFT calculation is fully compatible with a missing column of Se atoms. This shows that DPC imaging, as an electric field sensitive technique, provides additional and remarkable information to the otherwise only structural analysis obtained with conventional STEM imaging.</jats:p>","lang":"eng"}],"citation":{"ieee":"M. Groll <i>et al.</i>, “DFT‐Assisted Investigation of the Electric Field and Charge Density Distribution of Pristine and Defective 2D WSe<sub>2</sub> by Differential Phase Contrast Imaging,” <i>Small</i>, 2024, doi: <a href=\"https://doi.org/10.1002/smll.202311635\">10.1002/smll.202311635</a>.","apa":"Groll, M., Bürger, J., Caltzidis, I., Jöns, K. D., Schmidt, W. G., Gerstmann, U., &#38; Lindner, J. K. N. (2024). DFT‐Assisted Investigation of the Electric Field and Charge Density Distribution of Pristine and Defective 2D WSe<sub>2</sub> by Differential Phase Contrast Imaging. <i>Small</i>. <a href=\"https://doi.org/10.1002/smll.202311635\">https://doi.org/10.1002/smll.202311635</a>","chicago":"Groll, Maja, Julius Bürger, Ioannis Caltzidis, Klaus D. Jöns, Wolf Gero Schmidt, Uwe Gerstmann, and Jörg K. N. Lindner. “DFT‐Assisted Investigation of the Electric Field and Charge Density Distribution of Pristine and Defective 2D WSe<sub>2</sub> by Differential Phase Contrast Imaging.” <i>Small</i>, 2024. <a href=\"https://doi.org/10.1002/smll.202311635\">https://doi.org/10.1002/smll.202311635</a>.","short":"M. Groll, J. Bürger, I. Caltzidis, K.D. Jöns, W.G. Schmidt, U. Gerstmann, J.K.N. Lindner, Small (2024).","mla":"Groll, Maja, et al. “DFT‐Assisted Investigation of the Electric Field and Charge Density Distribution of Pristine and Defective 2D WSe<sub>2</sub> by Differential Phase Contrast Imaging.” <i>Small</i>, Wiley, 2024, doi:<a href=\"https://doi.org/10.1002/smll.202311635\">10.1002/smll.202311635</a>.","bibtex":"@article{Groll_Bürger_Caltzidis_Jöns_Schmidt_Gerstmann_Lindner_2024, title={DFT‐Assisted Investigation of the Electric Field and Charge Density Distribution of Pristine and Defective 2D WSe<sub>2</sub> by Differential Phase Contrast Imaging}, DOI={<a href=\"https://doi.org/10.1002/smll.202311635\">10.1002/smll.202311635</a>}, journal={Small}, publisher={Wiley}, author={Groll, Maja and Bürger, Julius and Caltzidis, Ioannis and Jöns, Klaus D. and Schmidt, Wolf Gero and Gerstmann, Uwe and Lindner, Jörg K. N.}, year={2024} }","ama":"Groll M, Bürger J, Caltzidis I, et al. DFT‐Assisted Investigation of the Electric Field and Charge Density Distribution of Pristine and Defective 2D WSe<sub>2</sub> by Differential Phase Contrast Imaging. <i>Small</i>. Published online 2024. doi:<a href=\"https://doi.org/10.1002/smll.202311635\">10.1002/smll.202311635</a>"},"publication":"Small","doi":"10.1002/smll.202311635","user_id":"16199","language":[{"iso":"eng"}],"_id":"54868","publisher":"Wiley","article_type":"original","date_updated":"2025-12-05T13:39:01Z","publication_status":"published","author":[{"last_name":"Groll","first_name":"Maja","full_name":"Groll, Maja"},{"id":"46952","first_name":"Julius","last_name":"Bürger","full_name":"Bürger, Julius"},{"id":"87911","first_name":"Ioannis","last_name":"Caltzidis","full_name":"Caltzidis, Ioannis"},{"id":"85353","full_name":"Jöns, Klaus D.","first_name":"Klaus D.","last_name":"Jöns"},{"id":"468","full_name":"Schmidt, Wolf Gero","first_name":"Wolf Gero","last_name":"Schmidt","orcid":"0000-0002-2717-5076"},{"id":"171","full_name":"Gerstmann, Uwe","first_name":"Uwe","last_name":"Gerstmann","orcid":"0000-0002-4476-223X"},{"first_name":"Jörg K. N.","last_name":"Lindner","full_name":"Lindner, Jörg K. N.","id":"20797"}],"publication_identifier":{"issn":["1613-6810","1613-6829"]},"title":"DFT‐Assisted Investigation of the Electric Field and Charge Density Distribution of Pristine and Defective 2D WSe<sub>2</sub> by Differential Phase Contrast Imaging","year":"2024","status":"public"},{"status":"public","_id":"54856","publisher":"IOP Publishing","volume":2701,"user_id":"16199","citation":{"bibtex":"@article{Franzke_Schmidt_Gerstmann_2024, title={Relativistic calculation of the orbital hyperfine splitting in complex microscopic structures}, volume={2701}, DOI={<a href=\"https://doi.org/10.1088/1742-6596/2701/1/012094\">10.1088/1742-6596/2701/1/012094</a>}, number={1012094}, journal={Journal of Physics: Conference Series}, publisher={IOP Publishing}, author={Franzke, Katharina and Schmidt, Wolf Gero and Gerstmann, Uwe}, year={2024} }","ama":"Franzke K, Schmidt WG, Gerstmann U. Relativistic calculation of the orbital hyperfine splitting in complex microscopic structures. <i>Journal of Physics: Conference Series</i>. 2024;2701(1). doi:<a href=\"https://doi.org/10.1088/1742-6596/2701/1/012094\">10.1088/1742-6596/2701/1/012094</a>","mla":"Franzke, Katharina, et al. “Relativistic Calculation of the Orbital Hyperfine Splitting in Complex Microscopic Structures.” <i>Journal of Physics: Conference Series</i>, vol. 2701, no. 1, 012094, IOP Publishing, 2024, doi:<a href=\"https://doi.org/10.1088/1742-6596/2701/1/012094\">10.1088/1742-6596/2701/1/012094</a>.","short":"K. Franzke, W.G. Schmidt, U. Gerstmann, Journal of Physics: Conference Series 2701 (2024).","chicago":"Franzke, Katharina, Wolf Gero Schmidt, and Uwe Gerstmann. “Relativistic Calculation of the Orbital Hyperfine Splitting in Complex Microscopic Structures.” <i>Journal of Physics: Conference Series</i> 2701, no. 1 (2024). <a href=\"https://doi.org/10.1088/1742-6596/2701/1/012094\">https://doi.org/10.1088/1742-6596/2701/1/012094</a>.","ieee":"K. Franzke, W. G. Schmidt, and U. Gerstmann, “Relativistic calculation of the orbital hyperfine splitting in complex microscopic structures,” <i>Journal of Physics: Conference Series</i>, vol. 2701, no. 1, Art. no. 012094, 2024, doi: <a href=\"https://doi.org/10.1088/1742-6596/2701/1/012094\">10.1088/1742-6596/2701/1/012094</a>.","apa":"Franzke, K., Schmidt, W. G., &#38; Gerstmann, U. (2024). Relativistic calculation of the orbital hyperfine splitting in complex microscopic structures. <i>Journal of Physics: Conference Series</i>, <i>2701</i>(1), Article 012094. <a href=\"https://doi.org/10.1088/1742-6596/2701/1/012094\">https://doi.org/10.1088/1742-6596/2701/1/012094</a>"},"project":[{"name":"TRR 142: TRR 142 - Maßgeschneiderte nichtlineare Photonik: Von grundlegenden Konzepten zu funktionellen Strukturen","_id":"53"},{"_id":"54","name":"TRR 142 - A: TRR 142 - Project Area A"},{"_id":"55","name":"TRR 142 - B: TRR 142 - Project Area B"},{"name":"TRR 142 - A11: TRR 142 - Subproject A11","_id":"166"},{"_id":"168","name":"TRR 142 - B07: TRR 142 - Polaronen-Einfluss auf die optischen Eigenschaften von Lithiumniobat (B07*)"},{"name":"PC2: Computing Resources Provided by the Paderborn Center for Parallel Computing","_id":"52"}],"author":[{"full_name":"Franzke, Katharina","last_name":"Franzke","first_name":"Katharina"},{"full_name":"Schmidt, Wolf Gero","orcid":"0000-0002-2717-5076","first_name":"Wolf Gero","last_name":"Schmidt","id":"468"},{"orcid":"0000-0002-4476-223X","first_name":"Uwe","last_name":"Gerstmann","full_name":"Gerstmann, Uwe","id":"171"}],"publication_identifier":{"issn":["1742-6588","1742-6596"]},"title":"Relativistic calculation of the orbital hyperfine splitting in complex microscopic structures","year":"2024","intvolume":"      2701","date_updated":"2025-12-05T13:36:01Z","publication_status":"published","language":[{"iso":"eng"}],"article_number":"012094","doi":"10.1088/1742-6596/2701/1/012094","publication":"Journal of Physics: Conference Series","issue":"1","abstract":[{"lang":"eng","text":"<jats:title>Abstract</jats:title>\r\n               <jats:p>Theoretical spectroscopy based on double perturbation theory is typically challenged by systems with large orbital hyperfine splitting. Therefore, we here derive a rigorous, non-perturbative scheme starting from Dirac’s equation which allows to calculate the contribution of the orbital HFI for complex structures including heavy atoms with strong spin-orbit coupling (SOC). Using the PAW formalism, the method has been implemented in the software package Quantum ESPRESSO. We show that the ‘orbital part’ actually scales with SOC strength if orbital quenching is hindered by low local symmetry, i.e. in case of dimers or atoms at surfaces. This holds true in particular when the unpaired electron is localized in quasi-atomic <jats:italic>p</jats:italic>-like orbitals. Here, the orbital part is by far not negligible, but becomes dominant by surpassing the dipolar contribution by a factor of five.</jats:p>"}],"date_created":"2024-06-24T06:26:02Z","department":[{"_id":"15"},{"_id":"170"},{"_id":"295"},{"_id":"790"},{"_id":"230"},{"_id":"429"},{"_id":"27"},{"_id":"35"}],"type":"journal_article"},{"intvolume":"       146","date_updated":"2025-12-05T13:37:59Z","publication_status":"published","publication_identifier":{"issn":["0002-7863","1520-5126"]},"author":[{"full_name":"Diederich, Jonathan","last_name":"Diederich","first_name":"Jonathan"},{"full_name":"Velasquez Rojas, Jennifer","last_name":"Velasquez Rojas","first_name":"Jennifer"},{"first_name":"Mohammad Amin","last_name":"Zare Pour","full_name":"Zare Pour, Mohammad Amin"},{"orcid":"0000-0002-4710-1170","first_name":"Isaac Azahel","last_name":"Ruiz Alvarado","full_name":"Ruiz Alvarado, Isaac Azahel","id":"79462"},{"first_name":"Agnieszka","last_name":"Paszuk","full_name":"Paszuk, Agnieszka"},{"first_name":"Rachele","last_name":"Sciotto","full_name":"Sciotto, Rachele"},{"first_name":"Christian","last_name":"Höhn","full_name":"Höhn, Christian"},{"first_name":"Klaus","last_name":"Schwarzburg","full_name":"Schwarzburg, Klaus"},{"last_name":"Ostheimer","first_name":"David","full_name":"Ostheimer, David"},{"full_name":"Eichberger, Rainer","last_name":"Eichberger","first_name":"Rainer"},{"id":"468","full_name":"Schmidt, Wolf Gero","orcid":"0000-0002-2717-5076","first_name":"Wolf Gero","last_name":"Schmidt"},{"first_name":"Thomas","last_name":"Hannappel","full_name":"Hannappel, Thomas"},{"full_name":"van de Krol, Roel","last_name":"van de Krol","first_name":"Roel"},{"full_name":"Friedrich, Dennis","first_name":"Dennis","last_name":"Friedrich"}],"year":"2024","title":"Unraveling Electron Dynamics in p-type Indium Phosphide (100): A Time-Resolved Two-Photon Photoemission Study","doi":"10.1021/jacs.3c12487","language":[{"iso":"eng"}],"issue":"13","publication":"Journal of the American Chemical Society","department":[{"_id":"15"},{"_id":"170"},{"_id":"295"},{"_id":"230"},{"_id":"27"},{"_id":"35"}],"type":"journal_article","date_created":"2024-06-24T09:42:46Z","status":"public","volume":146,"user_id":"16199","publisher":"American Chemical Society (ACS)","_id":"54866","page":"8949-8960","project":[{"name":"Computing Resources Provided by the Paderborn Center for Parallel Computing","_id":"52"}],"citation":{"apa":"Diederich, J., Velasquez Rojas, J., Zare Pour, M. A., Ruiz Alvarado, I. A., Paszuk, A., Sciotto, R., Höhn, C., Schwarzburg, K., Ostheimer, D., Eichberger, R., Schmidt, W. G., Hannappel, T., van de Krol, R., &#38; Friedrich, D. (2024). Unraveling Electron Dynamics in p-type Indium Phosphide (100): A Time-Resolved Two-Photon Photoemission Study. <i>Journal of the American Chemical Society</i>, <i>146</i>(13), 8949–8960. <a href=\"https://doi.org/10.1021/jacs.3c12487\">https://doi.org/10.1021/jacs.3c12487</a>","ieee":"J. Diederich <i>et al.</i>, “Unraveling Electron Dynamics in p-type Indium Phosphide (100): A Time-Resolved Two-Photon Photoemission Study,” <i>Journal of the American Chemical Society</i>, vol. 146, no. 13, pp. 8949–8960, 2024, doi: <a href=\"https://doi.org/10.1021/jacs.3c12487\">10.1021/jacs.3c12487</a>.","short":"J. Diederich, J. Velasquez Rojas, M.A. Zare Pour, I.A. Ruiz Alvarado, A. Paszuk, R. Sciotto, C. Höhn, K. Schwarzburg, D. Ostheimer, R. Eichberger, W.G. Schmidt, T. Hannappel, R. van de Krol, D. Friedrich, Journal of the American Chemical Society 146 (2024) 8949–8960.","chicago":"Diederich, Jonathan, Jennifer Velasquez Rojas, Mohammad Amin Zare Pour, Isaac Azahel Ruiz Alvarado, Agnieszka Paszuk, Rachele Sciotto, Christian Höhn, et al. “Unraveling Electron Dynamics in P-Type Indium Phosphide (100): A Time-Resolved Two-Photon Photoemission Study.” <i>Journal of the American Chemical Society</i> 146, no. 13 (2024): 8949–60. <a href=\"https://doi.org/10.1021/jacs.3c12487\">https://doi.org/10.1021/jacs.3c12487</a>.","mla":"Diederich, Jonathan, et al. “Unraveling Electron Dynamics in P-Type Indium Phosphide (100): A Time-Resolved Two-Photon Photoemission Study.” <i>Journal of the American Chemical Society</i>, vol. 146, no. 13, American Chemical Society (ACS), 2024, pp. 8949–60, doi:<a href=\"https://doi.org/10.1021/jacs.3c12487\">10.1021/jacs.3c12487</a>.","ama":"Diederich J, Velasquez Rojas J, Zare Pour MA, et al. Unraveling Electron Dynamics in p-type Indium Phosphide (100): A Time-Resolved Two-Photon Photoemission Study. <i>Journal of the American Chemical Society</i>. 2024;146(13):8949-8960. doi:<a href=\"https://doi.org/10.1021/jacs.3c12487\">10.1021/jacs.3c12487</a>","bibtex":"@article{Diederich_Velasquez Rojas_Zare Pour_Ruiz Alvarado_Paszuk_Sciotto_Höhn_Schwarzburg_Ostheimer_Eichberger_et al._2024, title={Unraveling Electron Dynamics in p-type Indium Phosphide (100): A Time-Resolved Two-Photon Photoemission Study}, volume={146}, DOI={<a href=\"https://doi.org/10.1021/jacs.3c12487\">10.1021/jacs.3c12487</a>}, number={13}, journal={Journal of the American Chemical Society}, publisher={American Chemical Society (ACS)}, author={Diederich, Jonathan and Velasquez Rojas, Jennifer and Zare Pour, Mohammad Amin and Ruiz Alvarado, Isaac Azahel and Paszuk, Agnieszka and Sciotto, Rachele and Höhn, Christian and Schwarzburg, Klaus and Ostheimer, David and Eichberger, Rainer and et al.}, year={2024}, pages={8949–8960} }"}},{"intvolume":"         7","publication_status":"published","date_updated":"2025-12-05T13:36:19Z","publication_identifier":{"issn":["2571-9637"]},"author":[{"last_name":"Sciotto","first_name":"Rachele","full_name":"Sciotto, Rachele"},{"first_name":"Isaac Azahel","orcid":"0000-0002-4710-1170","last_name":"Ruiz Alvarado","full_name":"Ruiz Alvarado, Isaac Azahel","id":"79462"},{"id":"468","first_name":"Wolf Gero","last_name":"Schmidt","orcid":"0000-0002-2717-5076","full_name":"Schmidt, Wolf Gero"}],"title":"Substrate Doping and Defect Influence on P-Rich InP(001):H Surface Properties","year":"2024","doi":"10.3390/surfaces7010006","language":[{"iso":"eng"}],"abstract":[{"text":"<jats:p>Density-functional theory calculations on P-rich InP(001):H surfaces are presented. Depending on temperature, pressure and substrate doping, hydrogen desorption or adsorption will occur and influence the surface electronic properties. For p-doped samples, the charge transition levels of the P dangling bond defects resulting from H desorption will lead to Fermi level pinning in the lower half of the band gap. This explains recent experimental data. For n-doped substrates, H-deficient surfaces are the ground-state structure. This will lead to Fermi level pinning below the bulk conduction band minimum. Surface defects resulting from the adsorption of additional hydrogen can be expected as well, but affect the surface electronic properties less than H desorption.</jats:p>","lang":"eng"}],"issue":"1","publication":"Surfaces","department":[{"_id":"15"},{"_id":"170"},{"_id":"295"},{"_id":"230"},{"_id":"27"},{"_id":"35"}],"type":"journal_article","date_created":"2024-06-24T06:24:26Z","status":"public","volume":7,"user_id":"16199","publisher":"MDPI AG","_id":"54855","page":"79-87","project":[{"name":"PC2: Computing Resources Provided by the Paderborn Center for Parallel Computing","_id":"52"}],"citation":{"mla":"Sciotto, Rachele, et al. “Substrate Doping and Defect Influence on P-Rich InP(001):H Surface Properties.” <i>Surfaces</i>, vol. 7, no. 1, MDPI AG, 2024, pp. 79–87, doi:<a href=\"https://doi.org/10.3390/surfaces7010006\">10.3390/surfaces7010006</a>.","ama":"Sciotto R, Ruiz Alvarado IA, Schmidt WG. Substrate Doping and Defect Influence on P-Rich InP(001):H Surface Properties. <i>Surfaces</i>. 2024;7(1):79-87. doi:<a href=\"https://doi.org/10.3390/surfaces7010006\">10.3390/surfaces7010006</a>","bibtex":"@article{Sciotto_Ruiz Alvarado_Schmidt_2024, title={Substrate Doping and Defect Influence on P-Rich InP(001):H Surface Properties}, volume={7}, DOI={<a href=\"https://doi.org/10.3390/surfaces7010006\">10.3390/surfaces7010006</a>}, number={1}, journal={Surfaces}, publisher={MDPI AG}, author={Sciotto, Rachele and Ruiz Alvarado, Isaac Azahel and Schmidt, Wolf Gero}, year={2024}, pages={79–87} }","apa":"Sciotto, R., Ruiz Alvarado, I. A., &#38; Schmidt, W. G. (2024). Substrate Doping and Defect Influence on P-Rich InP(001):H Surface Properties. <i>Surfaces</i>, <i>7</i>(1), 79–87. <a href=\"https://doi.org/10.3390/surfaces7010006\">https://doi.org/10.3390/surfaces7010006</a>","ieee":"R. Sciotto, I. A. Ruiz Alvarado, and W. G. Schmidt, “Substrate Doping and Defect Influence on P-Rich InP(001):H Surface Properties,” <i>Surfaces</i>, vol. 7, no. 1, pp. 79–87, 2024, doi: <a href=\"https://doi.org/10.3390/surfaces7010006\">10.3390/surfaces7010006</a>.","short":"R. Sciotto, I.A. Ruiz Alvarado, W.G. Schmidt, Surfaces 7 (2024) 79–87.","chicago":"Sciotto, Rachele, Isaac Azahel Ruiz Alvarado, and Wolf Gero Schmidt. “Substrate Doping and Defect Influence on P-Rich InP(001):H Surface Properties.” <i>Surfaces</i> 7, no. 1 (2024): 79–87. <a href=\"https://doi.org/10.3390/surfaces7010006\">https://doi.org/10.3390/surfaces7010006</a>."}},{"intvolume":"        79","date_updated":"2025-12-05T13:36:47Z","publication_status":"published","author":[{"full_name":"Pfnür, H.","first_name":"H.","last_name":"Pfnür"},{"full_name":"Tegenkamp, C.","last_name":"Tegenkamp","first_name":"C."},{"first_name":"S.","last_name":"Sanna","full_name":"Sanna, S."},{"full_name":"Jeckelmann, E.","first_name":"E.","last_name":"Jeckelmann"},{"last_name":"Horn-von Hoegen","first_name":"M.","full_name":"Horn-von Hoegen, M."},{"last_name":"Bovensiepen","first_name":"U.","full_name":"Bovensiepen, U."},{"first_name":"N.","last_name":"Esser","full_name":"Esser, N."},{"full_name":"Schmidt, Wolf Gero","first_name":"Wolf Gero","orcid":"0000-0002-2717-5076","last_name":"Schmidt","id":"468"},{"full_name":"Dähne, M.","last_name":"Dähne","first_name":"M."},{"first_name":"S.","last_name":"Wippermann","full_name":"Wippermann, S."},{"full_name":"Bechstedt, F.","first_name":"F.","last_name":"Bechstedt"},{"full_name":"Bode, M.","first_name":"M.","last_name":"Bode"},{"first_name":"R.","last_name":"Claessen","full_name":"Claessen, R."},{"full_name":"Ernstorfer, R.","first_name":"R.","last_name":"Ernstorfer"},{"full_name":"Hogan, C.","first_name":"C.","last_name":"Hogan"},{"full_name":"Ligges, M.","last_name":"Ligges","first_name":"M."},{"full_name":"Pucci, A.","last_name":"Pucci","first_name":"A."},{"first_name":"J.","last_name":"Schäfer","full_name":"Schäfer, J."},{"first_name":"E.","last_name":"Speiser","full_name":"Speiser, E."},{"first_name":"M.","last_name":"Wolf","full_name":"Wolf, M."},{"full_name":"Wollschläger, J.","last_name":"Wollschläger","first_name":"J."}],"publication_identifier":{"issn":["0167-5729"]},"year":"2024","title":"Atomic wires on substrates: Physics between one and two dimensions","doi":"10.1016/j.surfrep.2024.100629","language":[{"iso":"eng"}],"article_number":"100629","issue":"2","publication":"Surface Science Reports","department":[{"_id":"15"},{"_id":"170"},{"_id":"295"},{"_id":"230"},{"_id":"27"},{"_id":"35"}],"type":"journal_article","date_created":"2024-06-24T09:50:37Z","status":"public","volume":79,"user_id":"16199","_id":"54869","publisher":"Elsevier BV","project":[{"name":"PC2: Computing Resources Provided by the Paderborn Center for Parallel Computing","_id":"52"}],"citation":{"short":"H. Pfnür, C. Tegenkamp, S. Sanna, E. Jeckelmann, M. Horn-von Hoegen, U. Bovensiepen, N. Esser, W.G. Schmidt, M. Dähne, S. Wippermann, F. Bechstedt, M. Bode, R. Claessen, R. Ernstorfer, C. Hogan, M. Ligges, A. Pucci, J. Schäfer, E. Speiser, M. Wolf, J. Wollschläger, Surface Science Reports 79 (2024).","chicago":"Pfnür, H., C. Tegenkamp, S. Sanna, E. Jeckelmann, M. Horn-von Hoegen, U. Bovensiepen, N. Esser, et al. “Atomic Wires on Substrates: Physics between One and Two Dimensions.” <i>Surface Science Reports</i> 79, no. 2 (2024). <a href=\"https://doi.org/10.1016/j.surfrep.2024.100629\">https://doi.org/10.1016/j.surfrep.2024.100629</a>.","ieee":"H. Pfnür <i>et al.</i>, “Atomic wires on substrates: Physics between one and two dimensions,” <i>Surface Science Reports</i>, vol. 79, no. 2, Art. no. 100629, 2024, doi: <a href=\"https://doi.org/10.1016/j.surfrep.2024.100629\">10.1016/j.surfrep.2024.100629</a>.","apa":"Pfnür, H., Tegenkamp, C., Sanna, S., Jeckelmann, E., Horn-von Hoegen, M., Bovensiepen, U., Esser, N., Schmidt, W. G., Dähne, M., Wippermann, S., Bechstedt, F., Bode, M., Claessen, R., Ernstorfer, R., Hogan, C., Ligges, M., Pucci, A., Schäfer, J., Speiser, E., … Wollschläger, J. (2024). Atomic wires on substrates: Physics between one and two dimensions. <i>Surface Science Reports</i>, <i>79</i>(2), Article 100629. <a href=\"https://doi.org/10.1016/j.surfrep.2024.100629\">https://doi.org/10.1016/j.surfrep.2024.100629</a>","bibtex":"@article{Pfnür_Tegenkamp_Sanna_Jeckelmann_Horn-von Hoegen_Bovensiepen_Esser_Schmidt_Dähne_Wippermann_et al._2024, title={Atomic wires on substrates: Physics between one and two dimensions}, volume={79}, DOI={<a href=\"https://doi.org/10.1016/j.surfrep.2024.100629\">10.1016/j.surfrep.2024.100629</a>}, number={2100629}, journal={Surface Science Reports}, publisher={Elsevier BV}, author={Pfnür, H. and Tegenkamp, C. and Sanna, S. and Jeckelmann, E. and Horn-von Hoegen, M. and Bovensiepen, U. and Esser, N. and Schmidt, Wolf Gero and Dähne, M. and Wippermann, S. and et al.}, year={2024} }","ama":"Pfnür H, Tegenkamp C, Sanna S, et al. Atomic wires on substrates: Physics between one and two dimensions. <i>Surface Science Reports</i>. 2024;79(2). doi:<a href=\"https://doi.org/10.1016/j.surfrep.2024.100629\">10.1016/j.surfrep.2024.100629</a>","mla":"Pfnür, H., et al. “Atomic Wires on Substrates: Physics between One and Two Dimensions.” <i>Surface Science Reports</i>, vol. 79, no. 2, 100629, Elsevier BV, 2024, doi:<a href=\"https://doi.org/10.1016/j.surfrep.2024.100629\">10.1016/j.surfrep.2024.100629</a>."}},{"language":[{"iso":"eng"}],"article_number":"076201","doi":"10.1103/physrevlett.132.076201","publication_identifier":{"issn":["0031-9007","1079-7114"]},"author":[{"full_name":"Krenz, Marvin","last_name":"Krenz","first_name":"Marvin","id":"52309"},{"orcid":"0000-0002-4476-223X","last_name":"Gerstmann","first_name":"Uwe","full_name":"Gerstmann, Uwe","id":"171"},{"id":"468","full_name":"Schmidt, Wolf Gero","first_name":"Wolf Gero","last_name":"Schmidt","orcid":"0000-0002-2717-5076"}],"year":"2024","title":"Defect-Assisted Exciton Transfer across the Tetracene-Si(111):H Interface","intvolume":"       132","date_updated":"2025-12-05T13:38:22Z","publication_status":"published","date_created":"2024-06-24T09:39:42Z","department":[{"_id":"15"},{"_id":"170"},{"_id":"295"},{"_id":"790"},{"_id":"429"},{"_id":"27"},{"_id":"230"},{"_id":"35"}],"type":"journal_article","publication":"Physical Review Letters","issue":"7","_id":"54865","publisher":"American Physical Society (APS)","volume":132,"user_id":"16199","status":"public","citation":{"ieee":"M. Krenz, U. Gerstmann, and W. G. Schmidt, “Defect-Assisted Exciton Transfer across the Tetracene-Si(111):H Interface,” <i>Physical Review Letters</i>, vol. 132, no. 7, Art. no. 076201, 2024, doi: <a href=\"https://doi.org/10.1103/physrevlett.132.076201\">10.1103/physrevlett.132.076201</a>.","apa":"Krenz, M., Gerstmann, U., &#38; Schmidt, W. G. (2024). Defect-Assisted Exciton Transfer across the Tetracene-Si(111):H Interface. <i>Physical Review Letters</i>, <i>132</i>(7), Article 076201. <a href=\"https://doi.org/10.1103/physrevlett.132.076201\">https://doi.org/10.1103/physrevlett.132.076201</a>","short":"M. Krenz, U. Gerstmann, W.G. Schmidt, Physical Review Letters 132 (2024).","chicago":"Krenz, Marvin, Uwe Gerstmann, and Wolf Gero Schmidt. “Defect-Assisted Exciton Transfer across the Tetracene-Si(111):H Interface.” <i>Physical Review Letters</i> 132, no. 7 (2024). <a href=\"https://doi.org/10.1103/physrevlett.132.076201\">https://doi.org/10.1103/physrevlett.132.076201</a>.","mla":"Krenz, Marvin, et al. “Defect-Assisted Exciton Transfer across the Tetracene-Si(111):H Interface.” <i>Physical Review Letters</i>, vol. 132, no. 7, 076201, American Physical Society (APS), 2024, doi:<a href=\"https://doi.org/10.1103/physrevlett.132.076201\">10.1103/physrevlett.132.076201</a>.","bibtex":"@article{Krenz_Gerstmann_Schmidt_2024, title={Defect-Assisted Exciton Transfer across the Tetracene-Si(111):H Interface}, volume={132}, DOI={<a href=\"https://doi.org/10.1103/physrevlett.132.076201\">10.1103/physrevlett.132.076201</a>}, number={7076201}, journal={Physical Review Letters}, publisher={American Physical Society (APS)}, author={Krenz, Marvin and Gerstmann, Uwe and Schmidt, Wolf Gero}, year={2024} }","ama":"Krenz M, Gerstmann U, Schmidt WG. Defect-Assisted Exciton Transfer across the Tetracene-Si(111):H Interface. <i>Physical Review Letters</i>. 2024;132(7). doi:<a href=\"https://doi.org/10.1103/physrevlett.132.076201\">10.1103/physrevlett.132.076201</a>"},"project":[{"_id":"53","name":"TRR 142: TRR 142 - Maßgeschneiderte nichtlineare Photonik: Von grundlegenden Konzepten zu funktionellen Strukturen"},{"name":"TRR 142 - A: TRR 142 - Project Area A","_id":"54"},{"_id":"55","name":"TRR 142 - B: TRR 142 - Project Area B"},{"_id":"168","name":"TRR 142 - B07: TRR 142 - Polaronen-Einfluss auf die optischen Eigenschaften von Lithiumniobat (B07*)"},{"_id":"166","name":"TRR 142 - A11: TRR 142 - Subproject A11"},{"_id":"52","name":"PC2: Computing Resources Provided by the Paderborn Center for Parallel Computing"}]},{"doi":"10.1063/5.0214197","language":[{"iso":"eng"}],"article_number":"036110","intvolume":"         1","publication_status":"published","date_updated":"2025-12-05T13:55:00Z","publication_identifier":{"issn":["2835-0103"]},"author":[{"first_name":"David","last_name":"Bauch","full_name":"Bauch, David"},{"id":"79191","last_name":"Köcher","first_name":"Nikolas","full_name":"Köcher, Nikolas"},{"full_name":"Heinisch, Nils","orcid":"0009-0006-0984-2097","last_name":"Heinisch","first_name":"Nils","id":"90283"},{"id":"27271","first_name":"Stefan","last_name":"Schumacher","orcid":"0000-0003-4042-4951","full_name":"Schumacher, Stefan"}],"title":"Time-bin entanglement in the deterministic generation of linear photonic cluster states","year":"2024","department":[{"_id":"15"},{"_id":"170"},{"_id":"297"},{"_id":"705"},{"_id":"35"},{"_id":"27"},{"_id":"429"},{"_id":"230"},{"_id":"623"}],"type":"journal_article","date_created":"2025-12-04T12:35:53Z","abstract":[{"lang":"eng","text":"<jats:p>We theoretically investigate strategies for the deterministic creation of trains of time-bin entangled photons using an individual quantum emitter described by a Λ-type electronic system. We explicitly demonstrate the theoretical generation of linear cluster states with substantial numbers of entangled photonic qubits in full microscopic numerical simulations. The underlying scheme is based on the manipulation of ground state coherences through precise optical driving. One important finding is that the most easily accessible quality metrics, the achievable rotation fidelities, fall short in assessing the actual quantum correlations of the emitted photons in the face of losses. To address this, we explicitly calculate stabilizer generator expectation values as a superior gauge for the quantum properties of the generated many-photon state. With widespread applicability in other emitter and excitation–emission schemes also, our work lays the conceptual foundations for an in-depth practical analysis of time-bin entanglement based on full numerical simulations with predictive capabilities for realistic systems and setups, including losses and imperfections. The specific results shown in the present work illustrate that with controlled minimization of losses and realistic system parameters for quantum-dot type systems, useful linear cluster states of significant lengths can be generated in the calculations, discussing the possibility of scalability for quantum information processing endeavors.</jats:p>"}],"issue":"3","publication":"APL Quantum","volume":1,"user_id":"16199","publisher":"AIP Publishing","_id":"62868","status":"public","project":[{"name":"Computing Resources Provided by the Paderborn Center for Parallel Computing","_id":"52"},{"name":"TRR 142; TP C09: Ideale Erzeugung von Photonenpaaren für Verschränkungsaustausch bei Telekom Wellenlängen","_id":"173"},{"name":"PhoQC: Photonisches Quantencomputing","_id":"266"},{"name":"TRR 142: Maßgeschneiderte nichtlineare Photonik: Von grundlegenden Konzepten zu funktionellen Strukturen","_id":"53"},{"_id":"56","name":"TRR 142 - Project Area C"}],"citation":{"mla":"Bauch, David, et al. “Time-Bin Entanglement in the Deterministic Generation of Linear Photonic Cluster States.” <i>APL Quantum</i>, vol. 1, no. 3, 036110, AIP Publishing, 2024, doi:<a href=\"https://doi.org/10.1063/5.0214197\">10.1063/5.0214197</a>.","ama":"Bauch D, Köcher N, Heinisch N, Schumacher S. Time-bin entanglement in the deterministic generation of linear photonic cluster states. <i>APL Quantum</i>. 2024;1(3). doi:<a href=\"https://doi.org/10.1063/5.0214197\">10.1063/5.0214197</a>","bibtex":"@article{Bauch_Köcher_Heinisch_Schumacher_2024, title={Time-bin entanglement in the deterministic generation of linear photonic cluster states}, volume={1}, DOI={<a href=\"https://doi.org/10.1063/5.0214197\">10.1063/5.0214197</a>}, number={3036110}, journal={APL Quantum}, publisher={AIP Publishing}, author={Bauch, David and Köcher, Nikolas and Heinisch, Nils and Schumacher, Stefan}, year={2024} }","apa":"Bauch, D., Köcher, N., Heinisch, N., &#38; Schumacher, S. (2024). Time-bin entanglement in the deterministic generation of linear photonic cluster states. <i>APL Quantum</i>, <i>1</i>(3), Article 036110. <a href=\"https://doi.org/10.1063/5.0214197\">https://doi.org/10.1063/5.0214197</a>","ieee":"D. Bauch, N. Köcher, N. Heinisch, and S. Schumacher, “Time-bin entanglement in the deterministic generation of linear photonic cluster states,” <i>APL Quantum</i>, vol. 1, no. 3, Art. no. 036110, 2024, doi: <a href=\"https://doi.org/10.1063/5.0214197\">10.1063/5.0214197</a>.","short":"D. Bauch, N. Köcher, N. Heinisch, S. Schumacher, APL Quantum 1 (2024).","chicago":"Bauch, David, Nikolas Köcher, Nils Heinisch, and Stefan Schumacher. “Time-Bin Entanglement in the Deterministic Generation of Linear Photonic Cluster States.” <i>APL Quantum</i> 1, no. 3 (2024). <a href=\"https://doi.org/10.1063/5.0214197\">https://doi.org/10.1063/5.0214197</a>."}},{"_id":"62942","publisher":"Springer Science and Business Media LLC","volume":6,"user_id":"54649","status":"public","citation":{"mla":"Neßlinger, Vanessa, et al. “Interactions of Polyvinyl Acetate Dispersions with Nanostructured Superhydrophilic and Superhydrophobic Ti6Al4V Alloy Surfaces.” <i>Discover Applied Sciences</i>, vol. 6, no. 6, 294, Springer Science and Business Media LLC, 2024, doi:<a href=\"https://doi.org/10.1007/s42452-024-05916-z\">10.1007/s42452-024-05916-z</a>.","bibtex":"@article{Neßlinger_Atlanov_Grundmeier_2024, title={Interactions of polyvinyl acetate dispersions with nanostructured superhydrophilic and superhydrophobic Ti6Al4V alloy surfaces}, volume={6}, DOI={<a href=\"https://doi.org/10.1007/s42452-024-05916-z\">10.1007/s42452-024-05916-z</a>}, number={6294}, journal={Discover Applied Sciences}, publisher={Springer Science and Business Media LLC}, author={Neßlinger, Vanessa and Atlanov, Jan and Grundmeier, Guido}, year={2024} }","ama":"Neßlinger V, Atlanov J, Grundmeier G. Interactions of polyvinyl acetate dispersions with nanostructured superhydrophilic and superhydrophobic Ti6Al4V alloy surfaces. <i>Discover Applied Sciences</i>. 2024;6(6). doi:<a href=\"https://doi.org/10.1007/s42452-024-05916-z\">10.1007/s42452-024-05916-z</a>","ieee":"V. Neßlinger, J. Atlanov, and G. Grundmeier, “Interactions of polyvinyl acetate dispersions with nanostructured superhydrophilic and superhydrophobic Ti6Al4V alloy surfaces,” <i>Discover Applied Sciences</i>, vol. 6, no. 6, Art. no. 294, 2024, doi: <a href=\"https://doi.org/10.1007/s42452-024-05916-z\">10.1007/s42452-024-05916-z</a>.","apa":"Neßlinger, V., Atlanov, J., &#38; Grundmeier, G. (2024). Interactions of polyvinyl acetate dispersions with nanostructured superhydrophilic and superhydrophobic Ti6Al4V alloy surfaces. <i>Discover Applied Sciences</i>, <i>6</i>(6), Article 294. <a href=\"https://doi.org/10.1007/s42452-024-05916-z\">https://doi.org/10.1007/s42452-024-05916-z</a>","short":"V. Neßlinger, J. Atlanov, G. Grundmeier, Discover Applied Sciences 6 (2024).","chicago":"Neßlinger, Vanessa, Jan Atlanov, and Guido Grundmeier. “Interactions of Polyvinyl Acetate Dispersions with Nanostructured Superhydrophilic and Superhydrophobic Ti6Al4V Alloy Surfaces.” <i>Discover Applied Sciences</i> 6, no. 6 (2024). <a href=\"https://doi.org/10.1007/s42452-024-05916-z\">https://doi.org/10.1007/s42452-024-05916-z</a>."},"project":[{"name":"Computing Resources Provided by the Paderborn Center for Parallel Computing","_id":"52"}],"language":[{"iso":"eng"}],"article_number":"294","doi":"10.1007/s42452-024-05916-z","author":[{"id":"54649","last_name":"Neßlinger","first_name":"Vanessa","orcid":"0000-0001-9416-1646","full_name":"Neßlinger, Vanessa"},{"first_name":"Jan","last_name":"Atlanov","full_name":"Atlanov, Jan"},{"id":"194","full_name":"Grundmeier, Guido","last_name":"Grundmeier","first_name":"Guido"}],"publication_identifier":{"issn":["3004-9261"]},"year":"2024","title":"Interactions of polyvinyl acetate dispersions with nanostructured superhydrophilic and superhydrophobic Ti6Al4V alloy surfaces","intvolume":"         6","publication_status":"published","date_updated":"2025-12-08T08:33:00Z","date_created":"2025-12-08T08:32:26Z","department":[{"_id":"302"}],"type":"journal_article","publication":"Discover Applied Sciences","issue":"6","abstract":[{"text":"<jats:title>Abstract</jats:title><jats:p>Nanostructured bilayer thin films with superhydrophobic and superhydrophilic surfaces were prepared using Ti6Al4V alloy substrates which allowed for the comparative analysis of polyvinyl acetate (PVAc) particle adsorption as a function of the interface structure. The PVAc particles were obtained from emulsion polymerization of vinyl acetate. A superhydrophilic TiO<jats:sub>2</jats:sub> nanofiber-based 3D network was created on the Ti6Al4V alloy substrate by application of a hydrothermal method. Subsequent UV-grafting of ultra-thin polydimethylsiloxane (PDMS) layers resulted in a superhydrophobic surface. The modification steps were followed via Diffuse Reflectance Infrared Fourier Transform Spectroscopy, X-ray Photoelectron Spectroscopy, Field Emission-Scanning Electron Microscopy, contact angle and Electrochemical Impedance Spectroscopy. A mechanism for the adsorption of PVAc at the two electrolyte/substrate interfaces could be revealed.</jats:p>","lang":"eng"}]},{"title":"Scalable quantum detector tomography by high-performance computing","year":"2024","author":[{"id":"55629","full_name":"Schapeler, Timon","last_name":"Schapeler","first_name":"Timon","orcid":"0000-0001-7652-1716"},{"orcid":"0000-0002-6268-5397","first_name":"Robert","last_name":"Schade","full_name":"Schade, Robert","id":"75963"},{"id":"24135","first_name":"Michael","orcid":"0000-0002-5708-7632","last_name":"Lass","full_name":"Lass, Michael"},{"last_name":"Plessl","first_name":"Christian","orcid":"0000-0001-5728-9982","full_name":"Plessl, Christian","id":"16153"},{"full_name":"Bartley, Tim","last_name":"Bartley","first_name":"Tim","id":"49683"}],"date_updated":"2025-12-16T11:32:12Z","intvolume":"        10","main_file_link":[{"open_access":"1"}],"language":[{"iso":"eng"}],"doi":"10.1088/2058-9565/ad8511","issue":"1","publication":"Quantum Science and Technology","abstract":[{"text":"At large scales, quantum systems may become advantageous over their classical counterparts at performing certain tasks. Developing tools to analyze these systems at the relevant scales, in a manner consistent with quantum mechanics, is therefore critical to benchmarking performance and characterizing their operation. While classical computational approaches cannot perform like-for-like computations of quantum systems beyond a certain scale, classical high-performance computing (HPC) may nevertheless be useful for precisely these characterization and certification tasks. By developing open-source customized algorithms using high-performance computing, we perform quantum tomography on a megascale quantum photonic detector covering a Hilbert space of 106. This requires finding 108 elements of the matrix corresponding to the positive operator valued measure (POVM), the quantum description of the detector, and is achieved in minutes of computation time. Moreover, by exploiting the structure of the problem, we achieve highly efficient parallel scaling, paving the way for quantum objects up to a system size of 1012 elements to be reconstructed using this method. In general, this shows that a consistent quantum mechanical description of quantum phenomena is applicable at everyday scales. More concretely, this enables the reconstruction of large-scale quantum sources, processes and detectors used in computation and sampling tasks, which may be necessary to prove their nonclassical character or quantum computational advantage.","lang":"eng"}],"date_created":"2024-04-04T08:43:18Z","type":"journal_article","department":[{"_id":"27"},{"_id":"623"},{"_id":"15"}],"status":"public","publisher":"IOP Publishing","_id":"53202","user_id":"55629","volume":10,"citation":{"ama":"Schapeler T, Schade R, Lass M, Plessl C, Bartley T. Scalable quantum detector tomography by high-performance computing. <i>Quantum Science and Technology</i>. 2024;10(1). doi:<a href=\"https://doi.org/10.1088/2058-9565/ad8511\">10.1088/2058-9565/ad8511</a>","bibtex":"@article{Schapeler_Schade_Lass_Plessl_Bartley_2024, title={Scalable quantum detector tomography by high-performance computing}, volume={10}, DOI={<a href=\"https://doi.org/10.1088/2058-9565/ad8511\">10.1088/2058-9565/ad8511</a>}, number={1}, journal={Quantum Science and Technology}, publisher={IOP Publishing}, author={Schapeler, Timon and Schade, Robert and Lass, Michael and Plessl, Christian and Bartley, Tim}, year={2024} }","mla":"Schapeler, Timon, et al. “Scalable Quantum Detector Tomography by High-Performance Computing.” <i>Quantum Science and Technology</i>, vol. 10, no. 1, IOP Publishing, 2024, doi:<a href=\"https://doi.org/10.1088/2058-9565/ad8511\">10.1088/2058-9565/ad8511</a>.","chicago":"Schapeler, Timon, Robert Schade, Michael Lass, Christian Plessl, and Tim Bartley. “Scalable Quantum Detector Tomography by High-Performance Computing.” <i>Quantum Science and Technology</i> 10, no. 1 (2024). <a href=\"https://doi.org/10.1088/2058-9565/ad8511\">https://doi.org/10.1088/2058-9565/ad8511</a>.","short":"T. 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T."},{"full_name":"Meier, Torsten","orcid":"0000-0001-8864-2072","first_name":"Torsten","last_name":"Meier","id":"344"}],"publication_identifier":{"issn":["2469-9950","2469-9969"]},"type":"journal_article","department":[{"_id":"15"},{"_id":"170"},{"_id":"293"},{"_id":"35"},{"_id":"230"},{"_id":"429"}],"date_created":"2024-11-26T06:46:51Z","issue":"19","publication":"Physical Review B"},{"date_created":"2024-05-16T13:24:49Z","department":[{"_id":"27"},{"_id":"518"}],"type":"conference","citation":{"chicago":"Büttner, Markus, Christoph Alt, Tobias Kenter, Harald Köstler, Christian Plessl, and Vadym Aizinger. “Enabling Performance Portability for Shallow Water Equations on CPUs, GPUs, and FPGAs with SYCL.” In <i>Proceedings of the Platform for Advanced Scientific Computing Conference (PASC)</i>. ACM, 2024. <a href=\"https://doi.org/10.1145/3659914.3659925\">https://doi.org/10.1145/3659914.3659925</a>.","short":"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.","ieee":"M. Büttner, C. Alt, T. Kenter, H. Köstler, C. Plessl, and V. Aizinger, “Enabling Performance Portability for Shallow Water Equations on CPUs, GPUs, and FPGAs with SYCL,” 2024, doi: <a href=\"https://doi.org/10.1145/3659914.3659925\">10.1145/3659914.3659925</a>.","apa":"Büttner, M., Alt, C., Kenter, T., Köstler, H., Plessl, C., &#38; Aizinger, V. (2024). Enabling Performance Portability for Shallow Water Equations on CPUs, GPUs, and FPGAs with SYCL. <i>Proceedings of the Platform for Advanced Scientific Computing Conference (PASC)</i>, Article 11. <a href=\"https://doi.org/10.1145/3659914.3659925\">https://doi.org/10.1145/3659914.3659925</a>","bibtex":"@inproceedings{Büttner_Alt_Kenter_Köstler_Plessl_Aizinger_2024, title={Enabling Performance Portability for Shallow Water Equations on CPUs, GPUs, and FPGAs with SYCL}, DOI={<a href=\"https://doi.org/10.1145/3659914.3659925\">10.1145/3659914.3659925</a>}, number={11}, booktitle={Proceedings of the Platform for Advanced Scientific Computing Conference (PASC)}, publisher={ACM}, author={Büttner, Markus and Alt, Christoph and Kenter, Tobias and Köstler, Harald and Plessl, Christian and Aizinger, Vadym}, year={2024} }","ama":"Büttner M, Alt C, Kenter T, Köstler H, Plessl C, Aizinger V. Enabling Performance Portability for Shallow Water Equations on CPUs, GPUs, and FPGAs with SYCL. In: <i>Proceedings of the Platform for Advanced Scientific Computing Conference (PASC)</i>. ACM; 2024. doi:<a href=\"https://doi.org/10.1145/3659914.3659925\">10.1145/3659914.3659925</a>","mla":"Büttner, Markus, et al. “Enabling Performance Portability for Shallow Water Equations on CPUs, GPUs, and FPGAs with SYCL.” <i>Proceedings of the Platform for Advanced Scientific Computing Conference (PASC)</i>, 11, ACM, 2024, doi:<a href=\"https://doi.org/10.1145/3659914.3659925\">10.1145/3659914.3659925</a>."},"publication":"Proceedings of the Platform for Advanced Scientific Computing Conference (PASC)","project":[{"_id":"52","name":"PC2: Computing Resources Provided by the Paderborn Center for Parallel Computing"}],"quality_controlled":"1","_id":"54312","publisher":"ACM","language":[{"iso":"eng"}],"article_number":"11","doi":"10.1145/3659914.3659925","user_id":"16153","author":[{"full_name":"Büttner, Markus","first_name":"Markus","last_name":"Büttner"},{"id":"100625","full_name":"Alt, Christoph","first_name":"Christoph","last_name":"Alt"},{"first_name":"Tobias","last_name":"Kenter","full_name":"Kenter, Tobias","id":"3145"},{"last_name":"Köstler","first_name":"Harald","full_name":"Köstler, Harald"},{"id":"16153","full_name":"Plessl, Christian","last_name":"Plessl","orcid":"0000-0001-5728-9982","first_name":"Christian"},{"full_name":"Aizinger, Vadym","last_name":"Aizinger","first_name":"Vadym"}],"title":"Enabling Performance Portability for Shallow Water Equations on CPUs, GPUs, and FPGAs with SYCL","year":"2024","status":"public","date_updated":"2024-11-27T22:50:19Z","publication_status":"published"},{"doi":"10.3389/fpsyg.2024.1451309","main_file_link":[{"url":"https://www.frontiersin.org/journals/psychology/articles/10.3389/fpsyg.2024.1451309/abstract","open_access":"1"}],"language":[{"iso":"eng"}],"date_updated":"2024-12-02T09:41:36Z","publication_status":"published","intvolume":"        15","article_type":"original","year":"2024","title":"Benefiting from Binary Negations? Verbal Negations Decrease Visual Attention and Balance Its Distribution","author":[{"id":"38219","last_name":"Banh","first_name":"Ngoc Chi","orcid":"0000-0002-5946-4542","full_name":"Banh, Ngoc Chi"},{"last_name":"Tünnermann","first_name":"Jan","full_name":"Tünnermann, Jan"},{"full_name":"Rohlfing, Katharina J.","first_name":"Katharina J.","last_name":"Rohlfing","id":"50352"},{"first_name":"Ingrid","orcid":"0000-0003-2364-9489","last_name":"Scharlau","full_name":"Scharlau, Ingrid","id":"451"}],"type":"journal_article","department":[{"_id":"424"},{"_id":"660"}],"date_created":"2024-03-27T12:16:33Z","abstract":[{"lang":"eng","text":"Negated statements require more processing efforts than assertions. However, in certain contexts, repeating negations undergo adaptation, which over time mitigates the effort.\r\nHere, we ask negations hamper visual processing and whether consecutive repetitions mitigate its influence. \r\nWe assessed the overall attentional capacity and its distribution, the relative weight, quantitatively using \r\nthe formal Theory of Visual Attention (TVA).\r\nWe employed a very simple form for negations, binary negations. Negated instructions, expressing the only alternative to the core supposition, were cognitively demanding, resulting in a loss of attentional capacity in three experiments. The overall attentional capacity recovered gradually but stagnated at a lower level than with assertions, even after many repetitions. Additionally, negations distributed the attention equally between target and reference stimulus. Repetitions slightly increased the reference' share of attention. Assertions, on the other hand, shifted the attentional weight towards the target. Few repetitions slightly decreased the bias towards the target, many repetitions increased the bias."}],"publication":"Frontiers in Psychology","user_id":"38219","volume":15,"_id":"53072","status":"public","oa":"1","project":[{"name":"TRR 318 - A05: TRR 318 - Echtzeitmessung der Aufmerksamkeit im Mensch-Roboter-Erklärdialog (Teilprojekt A05)","_id":"115","grant_number":"438445824"},{"_id":"52","name":"PC2: Computing Resources Provided by the Paderborn Center for Parallel Computing"}],"citation":{"mla":"Banh, Ngoc Chi, et al. “Benefiting from Binary Negations? Verbal Negations Decrease Visual Attention and Balance Its Distribution.” <i>Frontiers in Psychology</i>, vol. 15, 2024, doi:<a href=\"https://doi.org/10.3389/fpsyg.2024.1451309\">10.3389/fpsyg.2024.1451309</a>.","ama":"Banh NC, Tünnermann J, Rohlfing KJ, Scharlau I. Benefiting from Binary Negations? Verbal Negations Decrease Visual Attention and Balance Its Distribution. <i>Frontiers in Psychology</i>. 2024;15. doi:<a href=\"https://doi.org/10.3389/fpsyg.2024.1451309\">10.3389/fpsyg.2024.1451309</a>","bibtex":"@article{Banh_Tünnermann_Rohlfing_Scharlau_2024, title={Benefiting from Binary Negations? Verbal Negations Decrease Visual Attention and Balance Its Distribution}, volume={15}, DOI={<a href=\"https://doi.org/10.3389/fpsyg.2024.1451309\">10.3389/fpsyg.2024.1451309</a>}, journal={Frontiers in Psychology}, author={Banh, Ngoc Chi and Tünnermann, Jan and Rohlfing, Katharina J. and Scharlau, Ingrid}, year={2024} }","apa":"Banh, N. C., Tünnermann, J., Rohlfing, K. J., &#38; Scharlau, I. (2024). Benefiting from Binary Negations? Verbal Negations Decrease Visual Attention and Balance Its Distribution. <i>Frontiers in Psychology</i>, <i>15</i>. <a href=\"https://doi.org/10.3389/fpsyg.2024.1451309\">https://doi.org/10.3389/fpsyg.2024.1451309</a>","ieee":"N. C. Banh, J. Tünnermann, K. J. Rohlfing, and I. Scharlau, “Benefiting from Binary Negations? Verbal Negations Decrease Visual Attention and Balance Its Distribution,” <i>Frontiers in Psychology</i>, vol. 15, 2024, doi: <a href=\"https://doi.org/10.3389/fpsyg.2024.1451309\">10.3389/fpsyg.2024.1451309</a>.","short":"N.C. Banh, J. Tünnermann, K.J. Rohlfing, I. Scharlau, Frontiers in Psychology 15 (2024).","chicago":"Banh, Ngoc Chi, Jan Tünnermann, Katharina J. Rohlfing, and Ingrid Scharlau. “Benefiting from Binary Negations? Verbal Negations Decrease Visual Attention and Balance Its Distribution.” <i>Frontiers in Psychology</i> 15 (2024). <a href=\"https://doi.org/10.3389/fpsyg.2024.1451309\">https://doi.org/10.3389/fpsyg.2024.1451309</a>."}},{"publication_identifier":{"issn":["1367-2630"]},"author":[{"first_name":"Usman","last_name":"Ali","full_name":"Ali, Usman"},{"full_name":"Holthaus, Martin","last_name":"Holthaus","first_name":"Martin"},{"id":"344","full_name":"Meier, Torsten","first_name":"Torsten","last_name":"Meier","orcid":"0000-0001-8864-2072"}],"year":"2024","title":"Floquet dynamics of ultracold atoms in optical lattices with a parametrically modulated trapping potential","intvolume":"        26","date_updated":"2024-12-18T14:00:41Z","publication_status":"published","language":[{"iso":"eng"}],"article_number":"123016","doi":"10.1088/1367-2630/ad9b47","issue":"12","publication":"New Journal of Physics","abstract":[{"lang":"eng","text":"<jats:title>Abstract</jats:title>\r\n               <jats:p>Experiments with ultracold atoms in optical lattices usually involve a weak parabolic trapping potential which merely serves to confine the atoms, but otherwise remains negligible. In contrast, we suggest a different class of experiments in which the presence of a stronger trap is an essential part of the set-up. Because the trap-modified on-site energies exhibit a slowly varying level spacing, similar to that of an anharmonic oscillator, an additional time-periodic trap modulation with judiciously chosen parameters creates nonlinear resonances which enable efficient Floquet engineering. We employ a Mathieu approximation for constructing the near-resonant Floquet states in an accurate manner and demonstrate the emergence of effective ground states from the resonant trap eigenstates. Moreover, we show that the population of the Floquet states is strongly affected by the phase of a sudden turn-on of the trap modulation, which leads to significantly modified and rich dynamics. As a guideline for further studies, we argue that the deliberate population of only the resonance-induced effective ground states will allow one to realize Floquet condensates which follow classical periodic orbits, thus providing challenging future perspectives for the investigation of the quantum–classical correspondence.</jats:p>"}],"date_created":"2024-12-18T13:59:34Z","department":[{"_id":"15"},{"_id":"170"},{"_id":"293"},{"_id":"35"},{"_id":"230"},{"_id":"27"}],"type":"journal_article","status":"public","_id":"57839","publisher":"IOP Publishing","volume":26,"user_id":"16199","citation":{"chicago":"Ali, Usman, Martin Holthaus, and Torsten Meier. “Floquet Dynamics of Ultracold Atoms in Optical Lattices with a Parametrically Modulated Trapping Potential.” <i>New Journal of Physics</i> 26, no. 12 (2024). <a href=\"https://doi.org/10.1088/1367-2630/ad9b47\">https://doi.org/10.1088/1367-2630/ad9b47</a>.","short":"U. Ali, M. Holthaus, T. Meier, New Journal of Physics 26 (2024).","ama":"Ali U, Holthaus M, Meier T. Floquet dynamics of ultracold atoms in optical lattices with a parametrically modulated trapping potential. <i>New Journal of Physics</i>. 2024;26(12). doi:<a href=\"https://doi.org/10.1088/1367-2630/ad9b47\">10.1088/1367-2630/ad9b47</a>","bibtex":"@article{Ali_Holthaus_Meier_2024, title={Floquet dynamics of ultracold atoms in optical lattices with a parametrically modulated trapping potential}, volume={26}, DOI={<a href=\"https://doi.org/10.1088/1367-2630/ad9b47\">10.1088/1367-2630/ad9b47</a>}, number={12123016}, journal={New Journal of Physics}, publisher={IOP Publishing}, author={Ali, Usman and Holthaus, Martin and Meier, Torsten}, year={2024} }","apa":"Ali, U., Holthaus, M., &#38; Meier, T. (2024). Floquet dynamics of ultracold atoms in optical lattices with a parametrically modulated trapping potential. <i>New Journal of Physics</i>, <i>26</i>(12), Article 123016. <a href=\"https://doi.org/10.1088/1367-2630/ad9b47\">https://doi.org/10.1088/1367-2630/ad9b47</a>","mla":"Ali, Usman, et al. “Floquet Dynamics of Ultracold Atoms in Optical Lattices with a Parametrically Modulated Trapping Potential.” <i>New Journal of Physics</i>, vol. 26, no. 12, 123016, IOP Publishing, 2024, doi:<a href=\"https://doi.org/10.1088/1367-2630/ad9b47\">10.1088/1367-2630/ad9b47</a>.","ieee":"U. Ali, M. Holthaus, and T. Meier, “Floquet dynamics of ultracold atoms in optical lattices with a parametrically modulated trapping potential,” <i>New Journal of Physics</i>, vol. 26, no. 12, Art. no. 123016, 2024, doi: <a href=\"https://doi.org/10.1088/1367-2630/ad9b47\">10.1088/1367-2630/ad9b47</a>."},"project":[{"_id":"52","name":"PC2: Computing Resources Provided by the Paderborn Center for Parallel Computing"}]}]
