---
_id: '61338'
abstract:
- lang: eng
  text: Conductive ferroelectric domain walls (DWs) represent a promising topical
    system for the development of nanoelectronic components and device sensors to
    be operational at elevated temperatures. DWs show very different properties as
    compared to their hosting bulk crystal, in particular with respect to the high
    local electrical conductivity. The objective of this work is to demonstrate DW
    conductivity up to temperatures as high as 400 °C which extends previous studies
    significantly. Experimental investigation of the DW conductivity of charged, inclined
    DWs is performed using 5 mol % MgO-doped lithium niobate single crystals. Current–voltage
    (  ) curves are determined by DC electrometer measurements and impedance spectroscopy
    and found to be identical. Moreover, impedance spectroscopy enables to recognize
    artifacts such as damaged electrodes. Temperature dependent measurements over
    repeated heating cycles reveal two distinct thermal activation energies for a
    given DW, with the higher of the activation energies only measured at higher temperatures.
    Depending on the specific sample, the higher activation energy is found above
    160 °C to 230 °C. This suggests, in turn, that more than one type of defect/polaron
    is involved, and that the dominant transport mechanism changes with increasing
    temperature. First principles atomistic modeling suggests that the conductivity
    of inclined domain walls cannot be solely explained by the formation of a 2D carrier
    gas and must be supported by hopping processes. This holds true even at temperatures
    as high as 400 °C. Our investigations underline the potential to extend DW current
    based nanoelectronic and sensor applications even into the so-far unexplored temperature
    range up to 400 °C.
article_number: '116949'
article_type: original
author:
- first_name: Hendrik
  full_name: Wulfmeier, Hendrik
  last_name: Wulfmeier
- first_name: Uliana
  full_name: Yakhnevych, Uliana
  last_name: Yakhnevych
- first_name: Cornelius
  full_name: Boekhoff, Cornelius
  last_name: Boekhoff
- first_name: Allan
  full_name: Diima, Allan
  last_name: Diima
- first_name: Marlo
  full_name: Kunzner, Marlo
  last_name: Kunzner
- first_name: Leonard M.
  full_name: Verhoff, Leonard M.
  last_name: Verhoff
- first_name: Jonas
  full_name: Paul, Jonas
  last_name: Paul
- first_name: Julius
  full_name: Ratzenberger, Julius
  last_name: Ratzenberger
- first_name: Elke
  full_name: Beyreuther, Elke
  last_name: Beyreuther
- first_name: Joshua
  full_name: Gössel, Joshua
  last_name: Gössel
- first_name: Iuliia
  full_name: Kiseleva, Iuliia
  last_name: Kiseleva
- first_name: Michael
  full_name: Rüsing, Michael
  id: '22501'
  last_name: Rüsing
  orcid: 0000-0003-4682-4577
- first_name: Simone
  full_name: Sanna, Simone
  last_name: Sanna
- first_name: Lukas M.
  full_name: Eng, Lukas M.
  last_name: Eng
- first_name: Holger
  full_name: Fritze, Holger
  last_name: Fritze
citation:
  ama: Wulfmeier H, Yakhnevych U, Boekhoff C, et al. Demonstration of domain wall
    current in MgO-doped lithium niobate single crystals up to 400°C. <i>Solid State
    Ionics</i>. 2025;429. doi:<a href="https://doi.org/10.1016/j.ssi.2025.116949">10.1016/j.ssi.2025.116949</a>
  apa: Wulfmeier, H., Yakhnevych, U., Boekhoff, C., Diima, A., Kunzner, M., Verhoff,
    L. M., Paul, J., Ratzenberger, J., Beyreuther, E., Gössel, J., Kiseleva, I., Rüsing,
    M., Sanna, S., Eng, L. M., &#38; Fritze, H. (2025). Demonstration of domain wall
    current in MgO-doped lithium niobate single crystals up to 400°C. <i>Solid State
    Ionics</i>, <i>429</i>, Article 116949. <a href="https://doi.org/10.1016/j.ssi.2025.116949">https://doi.org/10.1016/j.ssi.2025.116949</a>
  bibtex: '@article{Wulfmeier_Yakhnevych_Boekhoff_Diima_Kunzner_Verhoff_Paul_Ratzenberger_Beyreuther_Gössel_et
    al._2025, title={Demonstration of domain wall current in MgO-doped lithium niobate
    single crystals up to 400°C}, volume={429}, DOI={<a href="https://doi.org/10.1016/j.ssi.2025.116949">10.1016/j.ssi.2025.116949</a>},
    number={116949}, journal={Solid State Ionics}, publisher={Elsevier BV}, author={Wulfmeier,
    Hendrik and Yakhnevych, Uliana and Boekhoff, Cornelius and Diima, Allan and Kunzner,
    Marlo and Verhoff, Leonard M. and Paul, Jonas and Ratzenberger, Julius and Beyreuther,
    Elke and Gössel, Joshua and et al.}, year={2025} }'
  chicago: Wulfmeier, Hendrik, Uliana Yakhnevych, Cornelius Boekhoff, Allan Diima,
    Marlo Kunzner, Leonard M. Verhoff, Jonas Paul, et al. “Demonstration of Domain
    Wall Current in MgO-Doped Lithium Niobate Single Crystals up to 400°C.” <i>Solid
    State Ionics</i> 429 (2025). <a href="https://doi.org/10.1016/j.ssi.2025.116949">https://doi.org/10.1016/j.ssi.2025.116949</a>.
  ieee: 'H. Wulfmeier <i>et al.</i>, “Demonstration of domain wall current in MgO-doped
    lithium niobate single crystals up to 400°C,” <i>Solid State Ionics</i>, vol.
    429, Art. no. 116949, 2025, doi: <a href="https://doi.org/10.1016/j.ssi.2025.116949">10.1016/j.ssi.2025.116949</a>.'
  mla: Wulfmeier, Hendrik, et al. “Demonstration of Domain Wall Current in MgO-Doped
    Lithium Niobate Single Crystals up to 400°C.” <i>Solid State Ionics</i>, vol.
    429, 116949, Elsevier BV, 2025, doi:<a href="https://doi.org/10.1016/j.ssi.2025.116949">10.1016/j.ssi.2025.116949</a>.
  short: H. Wulfmeier, U. Yakhnevych, C. Boekhoff, A. Diima, M. Kunzner, L.M. Verhoff,
    J. Paul, J. Ratzenberger, E. Beyreuther, J. Gössel, I. Kiseleva, M. Rüsing, S.
    Sanna, L.M. Eng, H. Fritze, Solid State Ionics 429 (2025).
date_created: 2025-09-17T16:18:18Z
date_updated: 2025-09-17T16:19:51Z
department:
- _id: '15'
- _id: '288'
- _id: '623'
doi: 10.1016/j.ssi.2025.116949
intvolume: '       429'
language:
- iso: eng
main_file_link:
- open_access: '1'
  url: https://doi.org/10.1016/j.ssi.2025.116949
oa: '1'
publication: Solid State Ionics
publication_identifier:
  issn:
  - 0167-2738
publication_status: published
publisher: Elsevier BV
quality_controlled: '1'
status: public
title: Demonstration of domain wall current in MgO-doped lithium niobate single crystals
  up to 400°C
type: journal_article
user_id: '22501'
volume: 429
year: '2025'
...
---
_id: '61337'
abstract:
- lang: eng
  text: <jats:p>Lithium niobate–tantalate mixed (LNT) crystals promise improved performance
    and new applications for optical, piezomechanical, or electrical devices when
    compared to the end composition compounds lithium niobate and lithium tantalate.
    The macroscopic properties of ferroelectrics highly depend on the structure of
    the underlying ferroelectric domains, which within mixed crystals can interact
    with the local changes in chemical compositions. In this work, we demonstrate
    how ferroelectric domain walls can unambiguously be identified and distinguished
    from local changes in composition by correlating piezoresponse force microscopy
    with second harmonic generation microscopy, using the Cherenkov contrast, reference
    crystal contrast, and negative phase mismatching contrast. We demonstrate how
    measuring the associated intensity change when approaching negative phase mismatching
    can be used to deduce the local tantalum concentration fast and over a large sample
    area. Based on these results, we study the natural domain structures that appear
    from Czochralski-grown, multi-domain LNT solid solution crystals. The developed
    results and methods serve as the central foundation to poling these mixed crystal
    systems and are key for their integration and applications.</jats:p>
article_number: '034101'
author:
- first_name: Boris
  full_name: Koppitz, Boris
  last_name: Koppitz
- first_name: Tanya
  full_name: Saxena, Tanya
  last_name: Saxena
- first_name: Felix
  full_name: Bernhardt, Felix
  last_name: Bernhardt
- first_name: Steffen
  full_name: Ganschow, Steffen
  last_name: Ganschow
- first_name: Simone
  full_name: Sanna, Simone
  last_name: Sanna
- first_name: Michael
  full_name: Rüsing, Michael
  id: '22501'
  last_name: Rüsing
  orcid: 0000-0003-4682-4577
- first_name: Lukas M.
  full_name: Eng, Lukas M.
  last_name: Eng
citation:
  ama: Koppitz B, Saxena T, Bernhardt F, et al. Second harmonic generation contrasts
    of ferroelectric domain structures and composition in lithium niobate–tantalate
    mixed crystals. <i>Journal of Applied Physics</i>. 2025;138(3). doi:<a href="https://doi.org/10.1063/5.0276183">10.1063/5.0276183</a>
  apa: Koppitz, B., Saxena, T., Bernhardt, F., Ganschow, S., Sanna, S., Rüsing, M.,
    &#38; Eng, L. M. (2025). Second harmonic generation contrasts of ferroelectric
    domain structures and composition in lithium niobate–tantalate mixed crystals.
    <i>Journal of Applied Physics</i>, <i>138</i>(3), Article 034101. <a href="https://doi.org/10.1063/5.0276183">https://doi.org/10.1063/5.0276183</a>
  bibtex: '@article{Koppitz_Saxena_Bernhardt_Ganschow_Sanna_Rüsing_Eng_2025, title={Second
    harmonic generation contrasts of ferroelectric domain structures and composition
    in lithium niobate–tantalate mixed crystals}, volume={138}, DOI={<a href="https://doi.org/10.1063/5.0276183">10.1063/5.0276183</a>},
    number={3034101}, journal={Journal of Applied Physics}, publisher={AIP Publishing},
    author={Koppitz, Boris and Saxena, Tanya and Bernhardt, Felix and Ganschow, Steffen
    and Sanna, Simone and Rüsing, Michael and Eng, Lukas M.}, year={2025} }'
  chicago: Koppitz, Boris, Tanya Saxena, Felix Bernhardt, Steffen Ganschow, Simone
    Sanna, Michael Rüsing, and Lukas M. Eng. “Second Harmonic Generation Contrasts
    of Ferroelectric Domain Structures and Composition in Lithium Niobate–Tantalate
    Mixed Crystals.” <i>Journal of Applied Physics</i> 138, no. 3 (2025). <a href="https://doi.org/10.1063/5.0276183">https://doi.org/10.1063/5.0276183</a>.
  ieee: 'B. Koppitz <i>et al.</i>, “Second harmonic generation contrasts of ferroelectric
    domain structures and composition in lithium niobate–tantalate mixed crystals,”
    <i>Journal of Applied Physics</i>, vol. 138, no. 3, Art. no. 034101, 2025, doi:
    <a href="https://doi.org/10.1063/5.0276183">10.1063/5.0276183</a>.'
  mla: Koppitz, Boris, et al. “Second Harmonic Generation Contrasts of Ferroelectric
    Domain Structures and Composition in Lithium Niobate–Tantalate Mixed Crystals.”
    <i>Journal of Applied Physics</i>, vol. 138, no. 3, 034101, AIP Publishing, 2025,
    doi:<a href="https://doi.org/10.1063/5.0276183">10.1063/5.0276183</a>.
  short: B. Koppitz, T. Saxena, F. Bernhardt, S. Ganschow, S. Sanna, M. Rüsing, L.M.
    Eng, Journal of Applied Physics 138 (2025).
date_created: 2025-09-17T16:16:04Z
date_updated: 2025-09-17T16:18:02Z
department:
- _id: '15'
- _id: '623'
doi: 10.1063/5.0276183
funded_apc: '1'
intvolume: '       138'
issue: '3'
language:
- iso: eng
main_file_link:
- open_access: '1'
  url: https://pubs.aip.org/aip/jap/article/138/3/034101/3352909
oa: '1'
publication: Journal of Applied Physics
publication_identifier:
  issn:
  - 0021-8979
  - 1089-7550
publication_status: published
publisher: AIP Publishing
quality_controlled: '1'
status: public
title: Second harmonic generation contrasts of ferroelectric domain structures and
  composition in lithium niobate–tantalate mixed crystals
type: journal_article
user_id: '22501'
volume: 138
year: '2025'
...
---
_id: '61351'
abstract:
- lang: eng
  text: <jats:title>Abstract</jats:title><jats:p>The interaction of water molecules
    with semiconductor surfaces is relevant to various optoelectronic phenomena and
    physicochemical processes. Despite advances in fundamental understanding of water‐exposed
    surfaces, the detailed time‐ and energy‐resolved behavior of excited electrons
    remains largely unexplored. Here, the effects of water exposure on the near‐surface
    electron dynamics of phosphorus‐terminated p(2×2)/c(4×2)‐reconstructed indium
    phosphide (100) (P‐rich InP) are studied experimentally and matched to theoretical
    calculations. The P‐rich InP surface, consisting of H‐passivated P‐dimers, serves
    as a model for other P‐containing III‐V semiconductors such as gallium phosphide
    (GaP) or aluminum indium phosphide (AlInP). Electron dynamics near the surface
    are probed with femtosecond resolution using time‐resolved two‐photon photoemission
    (tr‐2PPE), a pump‐probe spectroscopic technique. Pulsed water exposure preserves
    electronic states and significantly increases lifetimes at the conduction band
    minimum (CBM). Density‐functional theory (DFT) calculations attribute these findings
    to suppression of surface vibrational modes in the top P‐layer by water exposure,
    reducing electronic transition probabilities of near‐band‐gap surface states.
    The results suggest that many near‐surface state lifetimes reported in ultra‐high
    vacuum may change significantly upon electrolyte exposure. These states may thus
    contribute more strongly to surface reactions than traditionally assumed. Demonstrating
    this effect for the technologically relevant P‐rich InP surface opens new opportunities
    in this underexplored area of surface electrochemistry.</jats:p>
article_number: e00463
author:
- first_name: Jonathan
  full_name: Diederich, Jonathan
  last_name: Diederich
- first_name: Agnieszka
  full_name: Paszuk, Agnieszka
  last_name: Paszuk
- first_name: Isaac Azahel
  full_name: Ruiz Alvarado, Isaac Azahel
  id: '79462'
  last_name: Ruiz Alvarado
  orcid: 0000-0002-4710-1170
- first_name: Marvin
  full_name: Krenz, Marvin
  last_name: Krenz
- first_name: Mohammad Amin
  full_name: Zare Pour, Mohammad Amin
  last_name: Zare Pour
- first_name: Diwakar Suresh
  full_name: Babu, Diwakar Suresh
  last_name: Babu
- first_name: Jennifer
  full_name: Velazquez Rojas, Jennifer
  last_name: Velazquez Rojas
- first_name: Christian
  full_name: Höhn, Christian
  last_name: Höhn
- first_name: Yuying
  full_name: Gao, Yuying
  last_name: Gao
- first_name: Klaus
  full_name: Schwarzburg, Klaus
  last_name: Schwarzburg
- first_name: David
  full_name: Ostheimer, David
  last_name: Ostheimer
- first_name: Rainer
  full_name: Eichberger, Rainer
  last_name: Eichberger
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: Thomas
  full_name: Hannappel, Thomas
  last_name: Hannappel
- first_name: Roel van
  full_name: de Krol, Roel van
  last_name: de Krol
- first_name: Dennis
  full_name: Friedrich, Dennis
  last_name: Friedrich
citation:
  ama: Diederich J, Paszuk A, Ruiz Alvarado IA, et al. Ultrafast Electron Dynamics
    at the Water‐Modified InP(100) Surface. <i>Advanced Materials Interfaces</i>.
    2025;12(16). doi:<a href="https://doi.org/10.1002/admi.202500463">10.1002/admi.202500463</a>
  apa: Diederich, J., Paszuk, A., Ruiz Alvarado, I. A., Krenz, M., Zare Pour, M. A.,
    Babu, D. S., Velazquez Rojas, J., Höhn, C., Gao, Y., Schwarzburg, K., Ostheimer,
    D., Eichberger, R., Schmidt, W. G., Hannappel, T., de Krol, R. van, &#38; Friedrich,
    D. (2025). Ultrafast Electron Dynamics at the Water‐Modified InP(100) Surface.
    <i>Advanced Materials Interfaces</i>, <i>12</i>(16), Article e00463. <a href="https://doi.org/10.1002/admi.202500463">https://doi.org/10.1002/admi.202500463</a>
  bibtex: '@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={<a href="https://doi.org/10.1002/admi.202500463">10.1002/admi.202500463</a>},
    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} }'
  chicago: Diederich, Jonathan, Agnieszka Paszuk, Isaac Azahel Ruiz Alvarado, Marvin
    Krenz, Mohammad Amin Zare Pour, Diwakar Suresh Babu, Jennifer Velazquez Rojas,
    et al. “Ultrafast Electron Dynamics at the Water‐Modified InP(100) Surface.” <i>Advanced
    Materials Interfaces</i> 12, no. 16 (2025). <a href="https://doi.org/10.1002/admi.202500463">https://doi.org/10.1002/admi.202500463</a>.
  ieee: 'J. Diederich <i>et al.</i>, “Ultrafast Electron Dynamics at the Water‐Modified
    InP(100) Surface,” <i>Advanced Materials Interfaces</i>, vol. 12, no. 16, Art.
    no. e00463, 2025, doi: <a href="https://doi.org/10.1002/admi.202500463">10.1002/admi.202500463</a>.'
  mla: Diederich, Jonathan, et al. “Ultrafast Electron Dynamics at the Water‐Modified
    InP(100) Surface.” <i>Advanced Materials Interfaces</i>, vol. 12, no. 16, e00463,
    Wiley, 2025, doi:<a href="https://doi.org/10.1002/admi.202500463">10.1002/admi.202500463</a>.
  short: J. Diederich, A. Paszuk, I.A. Ruiz Alvarado, M. Krenz, M.A. Zare Pour, D.S.
    Babu, J. Velazquez Rojas, C. Höhn, Y. Gao, K. Schwarzburg, D. Ostheimer, R. Eichberger,
    W.G. Schmidt, T. Hannappel, R. van de Krol, D. Friedrich, Advanced Materials Interfaces
    12 (2025).
date_created: 2025-09-18T11:03:16Z
date_updated: 2025-09-18T11:06:59Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '27'
- _id: '429'
doi: 10.1002/admi.202500463
intvolume: '        12'
issue: '16'
language:
- iso: eng
project:
- _id: '53'
  name: 'TRR 142: Maßgeschneiderte nichtlineare Photonik: Von grundlegenden Konzepten
    zu funktionellen Strukturen'
- _id: '55'
  name: TRR 142 - Project Area B
- _id: '168'
  name: TRR 142 - Polaronen-Einfluss auf die optischen Eigenschaften von Lithiumniobat
    (B07*)
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Advanced Materials Interfaces
publication_identifier:
  issn:
  - 2196-7350
  - 2196-7350
publication_status: published
publisher: Wiley
status: public
title: Ultrafast Electron Dynamics at the Water‐Modified InP(100) Surface
type: journal_article
user_id: '16199'
volume: 12
year: '2025'
...
---
_id: '61356'
abstract:
- lang: eng
  text: <jats:p>First-principles calculations reveal how topological defects in semiconducting
    carbon nanotubes trap triplet excitons and enable single-photon emission at telecom
    wavelengths, offering new insights into their potential for photonic devices.</jats:p>
author:
- first_name: Timur
  full_name: Biktagirov, Timur
  id: '65612'
  last_name: Biktagirov
- first_name: Uwe
  full_name: Gerstmann, Uwe
  id: '171'
  last_name: Gerstmann
  orcid: 0000-0002-4476-223X
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: Biktagirov T, Gerstmann U, Schmidt WG. Topological defects in semiconducting
    carbon nanotubes as triplet exciton traps and single-photon emitters. <i>Nanoscale</i>.
    2025;17(11):6884-6891. doi:<a href="https://doi.org/10.1039/d4nr03904a">10.1039/d4nr03904a</a>
  apa: Biktagirov, T., Gerstmann, U., &#38; Schmidt, W. G. (2025). Topological defects
    in semiconducting carbon nanotubes as triplet exciton traps and single-photon
    emitters. <i>Nanoscale</i>, <i>17</i>(11), 6884–6891. <a href="https://doi.org/10.1039/d4nr03904a">https://doi.org/10.1039/d4nr03904a</a>
  bibtex: '@article{Biktagirov_Gerstmann_Schmidt_2025, title={Topological defects
    in semiconducting carbon nanotubes as triplet exciton traps and single-photon
    emitters}, volume={17}, DOI={<a href="https://doi.org/10.1039/d4nr03904a">10.1039/d4nr03904a</a>},
    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} }'
  chicago: 'Biktagirov, Timur, Uwe Gerstmann, and Wolf Gero Schmidt. “Topological
    Defects in Semiconducting Carbon Nanotubes as Triplet Exciton Traps and Single-Photon
    Emitters.” <i>Nanoscale</i> 17, no. 11 (2025): 6884–91. <a href="https://doi.org/10.1039/d4nr03904a">https://doi.org/10.1039/d4nr03904a</a>.'
  ieee: 'T. Biktagirov, U. Gerstmann, and W. G. Schmidt, “Topological defects in semiconducting
    carbon nanotubes as triplet exciton traps and single-photon emitters,” <i>Nanoscale</i>,
    vol. 17, no. 11, pp. 6884–6891, 2025, doi: <a href="https://doi.org/10.1039/d4nr03904a">10.1039/d4nr03904a</a>.'
  mla: Biktagirov, Timur, et al. “Topological Defects in Semiconducting Carbon Nanotubes
    as Triplet Exciton Traps and Single-Photon Emitters.” <i>Nanoscale</i>, vol. 17,
    no. 11, Royal Society of Chemistry (RSC), 2025, pp. 6884–91, doi:<a href="https://doi.org/10.1039/d4nr03904a">10.1039/d4nr03904a</a>.
  short: T. Biktagirov, U. Gerstmann, W.G. Schmidt, Nanoscale 17 (2025) 6884–6891.
date_created: 2025-09-18T11:23:25Z
date_updated: 2025-09-18T11:26:23Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '790'
- _id: '35'
- _id: '230'
- _id: '27'
- _id: '429'
doi: 10.1039/d4nr03904a
intvolume: '        17'
issue: '11'
language:
- iso: eng
page: 6884-6891
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
- _id: '53'
  name: 'TRR 142: Maßgeschneiderte nichtlineare Photonik: Von grundlegenden Konzepten
    zu funktionellen Strukturen'
- _id: '54'
  name: TRR 142 - Project Area A
- _id: '55'
  name: TRR 142 - Project Area B
- _id: '168'
  name: TRR 142 - Polaronen-Einfluss auf die optischen Eigenschaften von Lithiumniobat
    (B07*)
- _id: '166'
  name: TRR 142 - Subproject A11
publication: Nanoscale
publication_identifier:
  issn:
  - 2040-3364
  - 2040-3372
publication_status: published
publisher: Royal Society of Chemistry (RSC)
status: public
title: Topological defects in semiconducting carbon nanotubes as triplet exciton traps
  and single-photon emitters
type: journal_article
user_id: '16199'
volume: 17
year: '2025'
...
---
_id: '58519'
abstract:
- lang: eng
  text: <jats:p>A unified theoretical approach to describe the properties of multimode
    squeezed light generated in a lossy medium is presented. This approach is valid
    for Markovian environments and includes both a model of discrete losses based
    on the beamsplitter approach and a generalized continuous loss model based on
    the spatial Langevin equation. For an important class of Gaussian states, we derive
    master equations for the second-order correlation functions and illustrate their
    solution for both frequency-independent and frequency-dependent losses. Studying
    the mode structure, we demonstrate that in a lossy environment no broadband basis
    without quadrature correlations between the different broadband modes exists.
    Therefore, various techniques and strategies to introduce broadband modes can
    be considered. We show that the Mercer expansion and the Williamson-Euler decomposition
    do not provide modes in which the maximal squeezing contained in the system can
    be measured. In turn, we find a new broadband basis that maximizes squeezing in
    the lossy system and present an algorithm to construct it.</jats:p>
article_number: '1621'
author:
- first_name: Denis A.
  full_name: Kopylov, Denis A.
  last_name: Kopylov
- first_name: Torsten
  full_name: Meier, Torsten
  id: '344'
  last_name: Meier
  orcid: 0000-0001-8864-2072
- first_name: Polina R.
  full_name: Sharapova, Polina R.
  id: '60286'
  last_name: Sharapova
citation:
  ama: Kopylov DA, Meier T, Sharapova PR. Theory of Multimode Squeezed Light Generation
    in Lossy Media. <i>Quantum</i>. 2025;9. doi:<a href="https://doi.org/10.22331/q-2025-02-04-1621">10.22331/q-2025-02-04-1621</a>
  apa: Kopylov, D. A., Meier, T., &#38; Sharapova, P. R. (2025). Theory of Multimode
    Squeezed Light Generation in Lossy Media. <i>Quantum</i>, <i>9</i>, Article 1621.
    <a href="https://doi.org/10.22331/q-2025-02-04-1621">https://doi.org/10.22331/q-2025-02-04-1621</a>
  bibtex: '@article{Kopylov_Meier_Sharapova_2025, title={Theory of Multimode Squeezed
    Light Generation in Lossy Media}, volume={9}, DOI={<a href="https://doi.org/10.22331/q-2025-02-04-1621">10.22331/q-2025-02-04-1621</a>},
    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} }'
  chicago: Kopylov, Denis A., Torsten Meier, and Polina R. Sharapova. “Theory of Multimode
    Squeezed Light Generation in Lossy Media.” <i>Quantum</i> 9 (2025). <a href="https://doi.org/10.22331/q-2025-02-04-1621">https://doi.org/10.22331/q-2025-02-04-1621</a>.
  ieee: 'D. A. Kopylov, T. Meier, and P. R. Sharapova, “Theory of Multimode Squeezed
    Light Generation in Lossy Media,” <i>Quantum</i>, vol. 9, Art. no. 1621, 2025,
    doi: <a href="https://doi.org/10.22331/q-2025-02-04-1621">10.22331/q-2025-02-04-1621</a>.'
  mla: Kopylov, Denis A., et al. “Theory of Multimode Squeezed Light Generation in
    Lossy Media.” <i>Quantum</i>, vol. 9, 1621, Verein zur Forderung des Open Access
    Publizierens in den Quantenwissenschaften, 2025, doi:<a href="https://doi.org/10.22331/q-2025-02-04-1621">10.22331/q-2025-02-04-1621</a>.
  short: D.A. Kopylov, T. Meier, P.R. Sharapova, Quantum 9 (2025).
date_created: 2025-02-05T12:57:37Z
date_updated: 2025-09-18T13:22:26Z
department:
- _id: '15'
- _id: '569'
- _id: '170'
- _id: '293'
- _id: '35'
- _id: '230'
- _id: '623'
- _id: '27'
doi: 10.22331/q-2025-02-04-1621
intvolume: '         9'
language:
- iso: eng
project:
- _id: '266'
  name: 'PhoQC: PhoQC: Photonisches Quantencomputing'
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Quantum
publication_identifier:
  issn:
  - 2521-327X
publication_status: published
publisher: Verein zur Forderung des Open Access Publizierens in den Quantenwissenschaften
status: public
title: Theory of Multimode Squeezed Light Generation in Lossy Media
type: journal_article
user_id: '16199'
volume: 9
year: '2025'
...
---
_id: '61271'
author:
- first_name: Cedric
  full_name: Tschöpe, Cedric
  last_name: Tschöpe
citation:
  ama: 'Tschöpe C. <i>Entwicklung flammgeschützter Kunststoffpulver für das Lasersintern:
    Einfluss von Phosphor-, Füllstoffanteilen und Belichtungsparametern</i>.; 2025.'
  apa: 'Tschöpe, C. (2025). <i>Entwicklung flammgeschützter Kunststoffpulver für das
    Lasersintern: Einfluss von Phosphor-, Füllstoffanteilen und Belichtungsparametern</i>.'
  bibtex: '@book{Tschöpe_2025, title={Entwicklung flammgeschützter Kunststoffpulver
    für das Lasersintern: Einfluss von Phosphor-, Füllstoffanteilen und Belichtungsparametern},
    author={Tschöpe, Cedric}, year={2025} }'
  chicago: 'Tschöpe, Cedric. <i>Entwicklung flammgeschützter Kunststoffpulver für
    das Lasersintern: Einfluss von Phosphor-, Füllstoffanteilen und Belichtungsparametern</i>,
    2025.'
  ieee: 'C. Tschöpe, <i>Entwicklung flammgeschützter Kunststoffpulver für das Lasersintern:
    Einfluss von Phosphor-, Füllstoffanteilen und Belichtungsparametern</i>. 2025.'
  mla: 'Tschöpe, Cedric. <i>Entwicklung flammgeschützter Kunststoffpulver für das
    Lasersintern: Einfluss von Phosphor-, Füllstoffanteilen und Belichtungsparametern</i>.
    2025.'
  short: 'C. Tschöpe, Entwicklung flammgeschützter Kunststoffpulver für das Lasersintern:
    Einfluss von Phosphor-, Füllstoffanteilen und Belichtungsparametern, 2025.'
date_created: 2025-09-15T08:11:45Z
date_updated: 2025-10-01T08:53:45Z
department:
- _id: '150'
- _id: '624'
- _id: '9'
language:
- iso: ger
status: public
supervisor:
- first_name: Hans-Joachim
  full_name: Schmid, Hans-Joachim
  id: '464'
  last_name: Schmid
  orcid: 000-0001-8590-1921
- first_name: Steffen
  full_name: Jesinghausen, Steffen
  id: '3959'
  last_name: Jesinghausen
  orcid: https://orcid.org/0000-0003-2611-5298
- first_name: Fabian
  full_name: Neitzel, Fabian
  id: '72307'
  last_name: Neitzel
  orcid: '0009-0004-8412-3645 '
title: 'Entwicklung flammgeschützter Kunststoffpulver für das Lasersintern: Einfluss
  von Phosphor-, Füllstoffanteilen und Belichtungsparametern'
type: mastersthesis
user_id: '72307'
year: '2025'
...
---
_id: '61485'
author:
- first_name: Thomas
  full_name: Frye, Thomas
  last_name: Frye
citation:
  ama: Frye T. <i>Untersuchung Der Wechselwirkungen Zwischen Aluminiumdiethylphosphinat
    Und Zinkbasierten Füllstoffen Als Synergistische Flammschutzmittel in Polyamid
    12 Für Das Selektive Lasersintern</i>.; 2025.
  apa: Frye, T. (2025). <i>Untersuchung der Wechselwirkungen zwischen Aluminiumdiethylphosphinat
    und zinkbasierten Füllstoffen als synergistische Flammschutzmittel in Polyamid
    12 für das selektive Lasersintern</i>.
  bibtex: '@book{Frye_2025, title={Untersuchung der Wechselwirkungen zwischen Aluminiumdiethylphosphinat
    und zinkbasierten Füllstoffen als synergistische Flammschutzmittel in Polyamid
    12 für das selektive Lasersintern}, author={Frye, Thomas}, year={2025} }'
  chicago: Frye, Thomas. <i>Untersuchung Der Wechselwirkungen Zwischen Aluminiumdiethylphosphinat
    Und Zinkbasierten Füllstoffen Als Synergistische Flammschutzmittel in Polyamid
    12 Für Das Selektive Lasersintern</i>, 2025.
  ieee: T. Frye, <i>Untersuchung der Wechselwirkungen zwischen Aluminiumdiethylphosphinat
    und zinkbasierten Füllstoffen als synergistische Flammschutzmittel in Polyamid
    12 für das selektive Lasersintern</i>. 2025.
  mla: Frye, Thomas. <i>Untersuchung Der Wechselwirkungen Zwischen Aluminiumdiethylphosphinat
    Und Zinkbasierten Füllstoffen Als Synergistische Flammschutzmittel in Polyamid
    12 Für Das Selektive Lasersintern</i>. 2025.
  short: T. Frye, Untersuchung Der Wechselwirkungen Zwischen Aluminiumdiethylphosphinat
    Und Zinkbasierten Füllstoffen Als Synergistische Flammschutzmittel in Polyamid
    12 Für Das Selektive Lasersintern, 2025.
date_created: 2025-10-01T08:55:57Z
date_updated: 2025-10-01T08:56:00Z
department:
- _id: '150'
- _id: '624'
- _id: '9'
language:
- iso: eng
status: public
supervisor:
- first_name: Hans-Joachim
  full_name: Schmid, Hans-Joachim
  id: '464'
  last_name: Schmid
  orcid: 000-0001-8590-1921
- first_name: Steffen
  full_name: Jesinghausen, Steffen
  id: '3959'
  last_name: Jesinghausen
  orcid: https://orcid.org/0000-0003-2611-5298
- first_name: Fabian
  full_name: Neitzel, Fabian
  id: '72307'
  last_name: Neitzel
  orcid: '0009-0004-8412-3645 '
title: Untersuchung der Wechselwirkungen zwischen Aluminiumdiethylphosphinat und zinkbasierten
  Füllstoffen als synergistische Flammschutzmittel in Polyamid 12 für das selektive
  Lasersintern
type: mastersthesis
user_id: '72307'
year: '2025'
...
---
_id: '60891'
abstract:
- lang: eng
  text: Straight dielectric waveguide channels made from slabs of thin-film lithium
    niobate (TFLN), or lithium niobate on insulator (LNOI), are investigated in the
    linear regime, for channels of rib and strip type with common trapezoidal cross
    sections, in Z-cut and X-cut samples at varying on-chip orientation. We clarify
    the theoretical basis for the waveguides with potentially non-diagonal core permittivity.
    Symmetry classes can be distinguished that differ in their consequences for potential
    modal degeneracy and polarization conversion. Our rigorous numerical analysis
    by means of a finite-element solver takes the anisotropy of the lithium niobate
    cores rigorously into account. We discuss extensive data for effective indices,
    polarization properties, and hybridization of guided modes, in single- and multimode
    channels. Scans over the waveguide width and orientation as primary parameters
    are complemented by a series of illustrations of vectorial mode profiles. These
    turn out to be essentially complex in cases of X-cut channels at non-crystal-axis-aligned
    orientations.
author:
- first_name: Manfred
  full_name: Hammer, Manfred
  id: '48077'
  last_name: Hammer
  orcid: 0000-0002-6331-9348
- first_name: Shahriar
  full_name: Khan, Shahriar
  last_name: Khan
- first_name: Behnood
  full_name: Taheri, Behnood
  last_name: Taheri
- first_name: Henna
  full_name: Farheen, Henna
  id: '53444'
  last_name: Farheen
  orcid: 0000-0001-7730-3489
- first_name: Jens
  full_name: Förstner, Jens
  id: '158'
  last_name: Förstner
  orcid: 0000-0001-7059-9862
citation:
  ama: 'Hammer M, Khan S, Taheri B, Farheen H, Förstner J. TFLN channel waveguides
    of rib and strip type: Properties of guided modes. <i>Optics Continuum</i>. 2025;4(10):2356.
    doi:<a href="https://doi.org/10.1364/optcon.569959">10.1364/optcon.569959</a>'
  apa: 'Hammer, M., Khan, S., Taheri, B., Farheen, H., &#38; Förstner, J. (2025).
    TFLN channel waveguides of rib and strip type: Properties of guided modes. <i>Optics
    Continuum</i>, <i>4</i>(10), 2356. <a href="https://doi.org/10.1364/optcon.569959">https://doi.org/10.1364/optcon.569959</a>'
  bibtex: '@article{Hammer_Khan_Taheri_Farheen_Förstner_2025, title={TFLN channel
    waveguides of rib and strip type: Properties of guided modes}, volume={4}, DOI={<a
    href="https://doi.org/10.1364/optcon.569959">10.1364/optcon.569959</a>}, number={10},
    journal={Optics Continuum}, publisher={Optica Publishing Group}, author={Hammer,
    Manfred and Khan, Shahriar and Taheri, Behnood and Farheen, Henna and Förstner,
    Jens}, year={2025}, pages={2356} }'
  chicago: 'Hammer, Manfred, Shahriar Khan, Behnood Taheri, Henna Farheen, and Jens
    Förstner. “TFLN Channel Waveguides of Rib and Strip Type: Properties of Guided
    Modes.” <i>Optics Continuum</i> 4, no. 10 (2025): 2356. <a href="https://doi.org/10.1364/optcon.569959">https://doi.org/10.1364/optcon.569959</a>.'
  ieee: 'M. Hammer, S. Khan, B. Taheri, H. Farheen, and J. Förstner, “TFLN channel
    waveguides of rib and strip type: Properties of guided modes,” <i>Optics Continuum</i>,
    vol. 4, no. 10, p. 2356, 2025, doi: <a href="https://doi.org/10.1364/optcon.569959">10.1364/optcon.569959</a>.'
  mla: 'Hammer, Manfred, et al. “TFLN Channel Waveguides of Rib and Strip Type: Properties
    of Guided Modes.” <i>Optics Continuum</i>, vol. 4, no. 10, Optica Publishing Group,
    2025, p. 2356, doi:<a href="https://doi.org/10.1364/optcon.569959">10.1364/optcon.569959</a>.'
  short: M. Hammer, S. Khan, B. Taheri, H. Farheen, J. Förstner, Optics Continuum
    4 (2025) 2356.
date_created: 2025-08-06T09:36:30Z
date_updated: 2025-10-05T11:52:55Z
ddc:
- '530'
department:
- _id: '61'
- _id: '230'
- _id: '429'
- _id: '623'
doi: 10.1364/optcon.569959
file:
- access_level: closed
  content_type: application/pdf
  creator: fossie
  date_created: 2025-10-05T11:48:25Z
  date_updated: 2025-10-05T11:48:25Z
  file_id: '61516'
  file_name: 2025-08 Hammer - Optics Continuum - TFLN channel waveguides of rib and
    strip type. Properties of guided modes (official version).pdf
  file_size: 5417636
  relation: main_file
  success: 1
file_date_updated: 2025-10-05T11:48:25Z
has_accepted_license: '1'
intvolume: '         4'
issue: '10'
keyword:
- tet_topic_waveguide
language:
- iso: eng
page: '2356'
publication: Optics Continuum
publication_identifier:
  issn:
  - 2770-0208
publication_status: published
publisher: Optica Publishing Group
status: public
title: 'TFLN channel waveguides of rib and strip type: Properties of guided modes'
type: journal_article
user_id: '158'
volume: 4
year: '2025'
...
---
_id: '61760'
abstract:
- lang: eng
  text: We present a topology-optimized silicon nitride (Si3N4) coupler designed to
    enhance the coupling efficiency between integrated single-photon emitters and
    photonic waveguide modes. By leveraging inverse design techniques, we optimize
    the coupler’s geometry to maximize power transfer while maintaining fabrication
    feasibility by improving mode overlap and directional emission, addressing the
    challenge of low coupling efficiency caused by size mismatch and material incompatibility.
    Simulations demonstrate a substantial enhancement in photon extraction and waveguide
    coupling. This approach can be extended to other photonic devices, offering a
    versatile framework for improving quantum light-matter interactions in integrated
    photonics.
author:
- first_name: Henna
  full_name: Farheen, Henna
  id: '53444'
  last_name: Farheen
  orcid: 0000-0001-7730-3489
- first_name: Yuheng
  full_name: Chen, Yuheng
  last_name: Chen
- first_name: Peigang
  full_name: Chen, Peigang
  last_name: Chen
- first_name: Artem
  full_name: Kryvobok, Artem
  last_name: Kryvobok
- first_name: Samuel
  full_name: Peana, Samuel
  last_name: Peana
- first_name: Alexander
  full_name: Senichev, Alexander
  last_name: Senichev
- first_name: Vladimir M.
  full_name: Shalaev, Vladimir M.
  last_name: Shalaev
- first_name: Alexandra
  full_name: Boltasseva, Alexandra
  last_name: Boltasseva
- first_name: Jens
  full_name: Förstner, Jens
  id: '158'
  last_name: Förstner
  orcid: 0000-0001-7059-9862
- first_name: Alexander V.
  full_name: Kildishev, Alexander V.
  last_name: Kildishev
citation:
  ama: 'Farheen H, Chen Y, Chen P, et al. Topology-optimized silicon nitride coupler
    for integrated single-photon emitters. In: Ni X, Cai W, eds. <i>Photonic Computing:
    From Materials and Devices to Systems and Applications II</i>. SPIE; 2025. doi:<a
    href="https://doi.org/10.1117/12.3065734">10.1117/12.3065734</a>'
  apa: 'Farheen, H., Chen, Y., Chen, P., Kryvobok, A., Peana, S., Senichev, A., Shalaev,
    V. M., Boltasseva, A., Förstner, J., &#38; Kildishev, A. V. (2025). Topology-optimized
    silicon nitride coupler for integrated single-photon emitters. In X. Ni &#38;
    W. Cai (Eds.), <i>Photonic Computing: From Materials and Devices to Systems and
    Applications II</i>. SPIE. <a href="https://doi.org/10.1117/12.3065734">https://doi.org/10.1117/12.3065734</a>'
  bibtex: '@inproceedings{Farheen_Chen_Chen_Kryvobok_Peana_Senichev_Shalaev_Boltasseva_Förstner_Kildishev_2025,
    title={Topology-optimized silicon nitride coupler for integrated single-photon
    emitters}, DOI={<a href="https://doi.org/10.1117/12.3065734">10.1117/12.3065734</a>},
    booktitle={Photonic Computing: From Materials and Devices to Systems and Applications
    II}, publisher={SPIE}, author={Farheen, Henna and Chen, Yuheng and Chen, Peigang
    and Kryvobok, Artem and Peana, Samuel and Senichev, Alexander and Shalaev, Vladimir
    M. and Boltasseva, Alexandra and Förstner, Jens and Kildishev, Alexander V.},
    editor={Ni, Xingjie and Cai, Wenshan}, year={2025} }'
  chicago: 'Farheen, Henna, Yuheng Chen, Peigang Chen, Artem Kryvobok, Samuel Peana,
    Alexander Senichev, Vladimir M. Shalaev, Alexandra Boltasseva, Jens Förstner,
    and Alexander V. Kildishev. “Topology-Optimized Silicon Nitride Coupler for Integrated
    Single-Photon Emitters.” In <i>Photonic Computing: From Materials and Devices
    to Systems and Applications II</i>, edited by Xingjie Ni and Wenshan Cai. SPIE,
    2025. <a href="https://doi.org/10.1117/12.3065734">https://doi.org/10.1117/12.3065734</a>.'
  ieee: 'H. Farheen <i>et al.</i>, “Topology-optimized silicon nitride coupler for
    integrated single-photon emitters,” in <i>Photonic Computing: From Materials and
    Devices to Systems and Applications II</i>, 2025, doi: <a href="https://doi.org/10.1117/12.3065734">10.1117/12.3065734</a>.'
  mla: 'Farheen, Henna, et al. “Topology-Optimized Silicon Nitride Coupler for Integrated
    Single-Photon Emitters.” <i>Photonic Computing: From Materials and Devices to
    Systems and Applications II</i>, edited by Xingjie Ni and Wenshan Cai, SPIE, 2025,
    doi:<a href="https://doi.org/10.1117/12.3065734">10.1117/12.3065734</a>.'
  short: 'H. Farheen, Y. Chen, P. Chen, A. Kryvobok, S. Peana, A. Senichev, V.M. Shalaev,
    A. Boltasseva, J. Förstner, A.V. Kildishev, in: X. Ni, W. Cai (Eds.), Photonic
    Computing: From Materials and Devices to Systems and Applications II, SPIE, 2025.'
date_created: 2025-10-08T15:20:13Z
date_updated: 2025-10-08T15:22:30Z
department:
- _id: '61'
- _id: '230'
- _id: '429'
- _id: '623'
doi: 10.1117/12.3065734
editor:
- first_name: Xingjie
  full_name: Ni, Xingjie
  last_name: Ni
- first_name: Wenshan
  full_name: Cai, Wenshan
  last_name: Cai
keyword:
- tet_topic_waveguide
language:
- iso: eng
publication: 'Photonic Computing: From Materials and Devices to Systems and Applications
  II'
publication_status: published
publisher: SPIE
status: public
title: Topology-optimized silicon nitride coupler for integrated single-photon emitters
type: conference
user_id: '158'
year: '2025'
...
---
_id: '61279'
abstract:
- lang: eng
  text: Spin waves represent an important class of low-energy excitations in magnetic
    solids, which influence the thermodynamic properties and play a major role in
    technical applications, such as spintronics or magnetic data storage. Despite
    the enormous advances of ab initio simulations in materials science, quantitative
    calculations of spin-wave spectra still pose a significant challenge, because
    the collective nature of the spin dynamics requires an accurate treatment of the
    Coulomb interaction between the electrons. As a consequence, simple lattice models
    like the Heisenberg Hamiltonian are still widespread in practical investigations,
    but modern techniques like time-dependent density-functional theory or many-body
    perturbation theory also open a route to material-specific spin-wave calculations
    from first principles. Although both are in principle exact, actual implementations
    necessarily employ approximations for electronic exchange and correlation as well
    as additional numerical simplifications. In this review, we recapitulate the theoretical
    foundations of ab initio spin-wave calculations and analyze the common approximations
    that underlie present implementations. In addition, we survey the available results
    for spin-wave dispersions of various magnetic materials and compare the performance
    of different computational approaches. In this way, we provide an overview of
    the present state of the art and identify directions for further developments.
article_number: '4431'
article_type: review
author:
- first_name: Michael
  full_name: Neugum, Michael
  id: '80813'
  last_name: Neugum
- first_name: Arno
  full_name: Schindlmayr, Arno
  id: '458'
  last_name: Schindlmayr
  orcid: 0000-0002-4855-071X
citation:
  ama: 'Neugum M, Schindlmayr A. Ab initio calculations of spin waves: A review of
    theoretical approaches and applications. <i>Materials</i>. 2025;18(18). doi:<a
    href="https://doi.org/10.3390/ma18184431">10.3390/ma18184431</a>'
  apa: 'Neugum, M., &#38; Schindlmayr, A. (2025). Ab initio calculations of spin waves:
    A review of theoretical approaches and applications. <i>Materials</i>, <i>18</i>(18),
    Article 4431. <a href="https://doi.org/10.3390/ma18184431">https://doi.org/10.3390/ma18184431</a>'
  bibtex: '@article{Neugum_Schindlmayr_2025, title={Ab initio calculations of spin
    waves: A review of theoretical approaches and applications}, volume={18}, DOI={<a
    href="https://doi.org/10.3390/ma18184431">10.3390/ma18184431</a>}, number={184431},
    journal={Materials}, publisher={MDPI}, author={Neugum, Michael and Schindlmayr,
    Arno}, year={2025} }'
  chicago: 'Neugum, Michael, and Arno Schindlmayr. “Ab Initio Calculations of Spin
    Waves: A Review of Theoretical Approaches and Applications.” <i>Materials</i>
    18, no. 18 (2025). <a href="https://doi.org/10.3390/ma18184431">https://doi.org/10.3390/ma18184431</a>.'
  ieee: 'M. Neugum and A. Schindlmayr, “Ab initio calculations of spin waves: A review
    of theoretical approaches and applications,” <i>Materials</i>, vol. 18, no. 18,
    Art. no. 4431, 2025, doi: <a href="https://doi.org/10.3390/ma18184431">10.3390/ma18184431</a>.'
  mla: 'Neugum, Michael, and Arno Schindlmayr. “Ab Initio Calculations of Spin Waves:
    A Review of Theoretical Approaches and Applications.” <i>Materials</i>, vol. 18,
    no. 18, 4431, MDPI, 2025, doi:<a href="https://doi.org/10.3390/ma18184431">10.3390/ma18184431</a>.'
  short: M. Neugum, A. Schindlmayr, Materials 18 (2025).
date_created: 2025-09-15T16:14:59Z
date_updated: 2025-10-10T07:31:23Z
ddc:
- '530'
department:
- _id: '296'
- _id: '15'
- _id: '170'
- _id: '35'
- _id: '230'
doi: 10.3390/ma18184431
external_id:
  isi:
  - '001580599300001'
file:
- access_level: open_access
  content_type: application/pdf
  creator: schindlm
  date_created: 2025-09-24T07:19:36Z
  date_updated: 2025-09-24T07:19:36Z
  description: Creative Commons Attribution 4.0 International Public License (CC BY
    4.0)
  file_id: '61422'
  file_name: materials-18-04431.pdf
  file_size: 611341
  relation: main_file
  title: 'Ab initio calculations of spin waves: A review of theoretical approaches
    and applications'
file_date_updated: 2025-09-24T07:19:36Z
has_accepted_license: '1'
intvolume: '        18'
isi: '1'
issue: '18'
language:
- iso: eng
oa: '1'
publication: Materials
publication_identifier:
  eissn:
  - 1996-1944
publication_status: published
publisher: MDPI
quality_controlled: '1'
status: public
title: 'Ab initio calculations of spin waves: A review of theoretical approaches and
  applications'
type: journal_article
user_id: '458'
volume: 18
year: '2025'
...
---
_id: '60959'
abstract:
- lang: eng
  text: Miller's rule originated as an empirical relation between the nonlinear and
    linear optical coefficients of materials. It is now accepted as a useful tool
    for guiding experiments and computational materials discovery, but its theoretical
    foundation had long been limited to a derivation for the classical Lorentz model
    with a weak anharmonic perturbation. Recently, we developed a mathematical framework
    which enabled us to prove that Miller's rule is equally valid for quantum anharmonic
    oscillators, despite different dynamics due to zero-point fluctuations and further
    quantum-mechanical effects. However, our previous derivation applied only to one-dimensional
    oscillators and to the special case of second- and third-harmonic generation in
    a monochromatic electric field. Here we extend the proof to three-dimensional
    quantum anharmonic oscillators and also treat all orders of the nonlinear response
    to an arbitrary multi-frequency field. This makes the results applicable to a
    much larger range of physical systems and nonlinear optical processes. The obtained
    generalized Miller formulae rigorously express all tensor elements of the frequency-dependent
    nonlinear susceptibilities in terms of the linear susceptibility and thus allow
    a computationally inexpensive quantitative prediction of arbitrary parametric
    frequency-mixing processes from a small initial dataset.
article_number: '34'
article_type: original
author:
- first_name: Maximilian Tim
  full_name: Meyer, Maximilian Tim
  id: '77895'
  last_name: Meyer
  orcid: 0009-0003-4899-0920
- first_name: Arno
  full_name: Schindlmayr, Arno
  id: '458'
  last_name: Schindlmayr
  orcid: 0000-0002-4855-071X
citation:
  ama: Meyer MT, Schindlmayr A. Generalized Miller formulae for quantum anharmonic
    oscillators. <i>Dynamics</i>. 2025;5(3). doi:<a href="https://doi.org/10.3390/dynamics5030034">10.3390/dynamics5030034</a>
  apa: Meyer, M. T., &#38; Schindlmayr, A. (2025). Generalized Miller formulae for
    quantum anharmonic oscillators. <i>Dynamics</i>, <i>5</i>(3), Article 34. <a href="https://doi.org/10.3390/dynamics5030034">https://doi.org/10.3390/dynamics5030034</a>
  bibtex: '@article{Meyer_Schindlmayr_2025, title={Generalized Miller formulae for
    quantum anharmonic oscillators}, volume={5}, DOI={<a href="https://doi.org/10.3390/dynamics5030034">10.3390/dynamics5030034</a>},
    number={334}, journal={Dynamics}, publisher={MDPI}, author={Meyer, Maximilian
    Tim and Schindlmayr, Arno}, year={2025} }'
  chicago: Meyer, Maximilian Tim, and Arno Schindlmayr. “Generalized Miller Formulae
    for Quantum Anharmonic Oscillators.” <i>Dynamics</i> 5, no. 3 (2025). <a href="https://doi.org/10.3390/dynamics5030034">https://doi.org/10.3390/dynamics5030034</a>.
  ieee: 'M. T. Meyer and A. Schindlmayr, “Generalized Miller formulae for quantum
    anharmonic oscillators,” <i>Dynamics</i>, vol. 5, no. 3, Art. no. 34, 2025, doi:
    <a href="https://doi.org/10.3390/dynamics5030034">10.3390/dynamics5030034</a>.'
  mla: Meyer, Maximilian Tim, and Arno Schindlmayr. “Generalized Miller Formulae for
    Quantum Anharmonic Oscillators.” <i>Dynamics</i>, vol. 5, no. 3, 34, MDPI, 2025,
    doi:<a href="https://doi.org/10.3390/dynamics5030034">10.3390/dynamics5030034</a>.
  short: M.T. Meyer, A. Schindlmayr, Dynamics 5 (2025).
date_created: 2025-08-20T09:46:13Z
date_updated: 2025-10-10T07:29:36Z
ddc:
- '530'
department:
- _id: '296'
- _id: '230'
- _id: '15'
- _id: '170'
- _id: '35'
doi: 10.3390/dynamics5030034
external_id:
  isi:
  - '001581270200001'
file:
- access_level: open_access
  content_type: application/pdf
  creator: schindlm
  date_created: 2025-08-28T12:23:26Z
  date_updated: 2025-08-28T12:27:05Z
  description: Creative Commons Attribution 4.0 International Public License (CC BY
    4.0)
  file_id: '61056'
  file_name: dynamics-05-00034.pdf
  file_size: 375897
  relation: main_file
  title: Generalized Miller formulae for quantum anharmonic oscillators
file_date_updated: 2025-08-28T12:27:05Z
has_accepted_license: '1'
intvolume: '         5'
isi: '1'
issue: '3'
language:
- iso: eng
oa: '1'
publication: Dynamics
publication_identifier:
  eissn:
  - 2673-8716
publication_status: published
publisher: MDPI
quality_controlled: '1'
status: public
title: Generalized Miller formulae for quantum anharmonic oscillators
type: journal_article
user_id: '458'
volume: 5
year: '2025'
...
---
_id: '61138'
article_number: '434'
author:
- first_name: Yingjie
  full_name: Zhan, Yingjie
  id: '93591'
  last_name: Zhan
- first_name: Ismail
  full_name: Caylak, Ismail
  id: '75'
  last_name: Caylak
- first_name: Richard
  full_name: Ostwald, Richard
  id: '106876'
  last_name: Ostwald
  orcid: 0000-0003-2147-8444
- first_name: Enrico
  full_name: Barth, Enrico
  last_name: Barth
- first_name: Eckart
  full_name: Uhlmann, Eckart
  last_name: Uhlmann
citation:
  ama: 'Zhan Y, Caylak I, Ostwald R, Barth E, Uhlmann E. Damage-incorporated four-step
    mean-field method for simulating CFRP machining: a novel algorithmic approach.
    <i>Multiscale and Multidisciplinary Modeling, Experiments and Design</i>. 2025;8(10).
    doi:<a href="https://doi.org/10.1007/s41939-025-01026-4">10.1007/s41939-025-01026-4</a>'
  apa: 'Zhan, Y., Caylak, I., Ostwald, R., Barth, E., &#38; Uhlmann, E. (2025). Damage-incorporated
    four-step mean-field method for simulating CFRP machining: a novel algorithmic
    approach. <i>Multiscale and Multidisciplinary Modeling, Experiments and Design</i>,
    <i>8</i>(10), Article 434. <a href="https://doi.org/10.1007/s41939-025-01026-4">https://doi.org/10.1007/s41939-025-01026-4</a>'
  bibtex: '@article{Zhan_Caylak_Ostwald_Barth_Uhlmann_2025, title={Damage-incorporated
    four-step mean-field method for simulating CFRP machining: a novel algorithmic
    approach}, volume={8}, DOI={<a href="https://doi.org/10.1007/s41939-025-01026-4">10.1007/s41939-025-01026-4</a>},
    number={10434}, journal={Multiscale and Multidisciplinary Modeling, Experiments
    and Design}, publisher={Springer Science and Business Media LLC}, author={Zhan,
    Yingjie and Caylak, Ismail and Ostwald, Richard and Barth, Enrico and Uhlmann,
    Eckart}, year={2025} }'
  chicago: 'Zhan, Yingjie, Ismail Caylak, Richard Ostwald, Enrico Barth, and Eckart
    Uhlmann. “Damage-Incorporated Four-Step Mean-Field Method for Simulating CFRP
    Machining: A Novel Algorithmic Approach.” <i>Multiscale and Multidisciplinary
    Modeling, Experiments and Design</i> 8, no. 10 (2025). <a href="https://doi.org/10.1007/s41939-025-01026-4">https://doi.org/10.1007/s41939-025-01026-4</a>.'
  ieee: 'Y. Zhan, I. Caylak, R. Ostwald, E. Barth, and E. Uhlmann, “Damage-incorporated
    four-step mean-field method for simulating CFRP machining: a novel algorithmic
    approach,” <i>Multiscale and Multidisciplinary Modeling, Experiments and Design</i>,
    vol. 8, no. 10, Art. no. 434, 2025, doi: <a href="https://doi.org/10.1007/s41939-025-01026-4">10.1007/s41939-025-01026-4</a>.'
  mla: 'Zhan, Yingjie, et al. “Damage-Incorporated Four-Step Mean-Field Method for
    Simulating CFRP Machining: A Novel Algorithmic Approach.” <i>Multiscale and Multidisciplinary
    Modeling, Experiments and Design</i>, vol. 8, no. 10, 434, Springer Science and
    Business Media LLC, 2025, doi:<a href="https://doi.org/10.1007/s41939-025-01026-4">10.1007/s41939-025-01026-4</a>.'
  short: Y. Zhan, I. Caylak, R. Ostwald, E. Barth, E. Uhlmann, Multiscale and Multidisciplinary
    Modeling, Experiments and Design 8 (2025).
date_created: 2025-09-05T07:40:31Z
date_updated: 2025-10-20T12:05:57Z
department:
- _id: '9'
- _id: '952'
- _id: '321'
doi: 10.1007/s41939-025-01026-4
intvolume: '         8'
issue: '10'
language:
- iso: eng
publication: Multiscale and Multidisciplinary Modeling, Experiments and Design
publication_identifier:
  issn:
  - 2520-8160
  - 2520-8179
publication_status: published
publisher: Springer Science and Business Media LLC
quality_controlled: '1'
status: public
title: 'Damage-incorporated four-step mean-field method for simulating CFRP machining:
  a novel algorithmic approach'
type: journal_article
user_id: '85414'
volume: 8
year: '2025'
...
---
_id: '62034'
abstract:
- lang: eng
  text: 'Effective single-particle theories, such as Hartree–Fock, density functional
    theory, and tight-binding, are limited by the computational cost of the self-consistent
    field (SCF) procedure, which typically scales cubically with the system size.
    This makes large-scale applications impractical without specialized algorithms
    and hardware. Here, we present the submatrix and graphical processing unit (GPU)-accelerated
    software implementation of the PTB tight-binding potential, realized in the open-source
    ptb codebase [M. Mueller, A. Katbashev, and S. Ehlert (2025). “grimme-lab/ptb:
    v3.8.1,” Zenodo. https://zenodo.org/records/17015872]. We first benchmark a traditional
    diagonalization-based SCF solver against density-matrix-based purification approaches,
    systematically varying both system size and computer hardware. Our findings show
    that the usage of GPUs permits shifting the boundaries to much larger systems
    than previously thought feasible, achieving an overall 10–15-fold performance
    speedup. Second, we introduce the implementation of a decomposition-type submatrix
    method, specifically designed for efficient operation on mid- to large-sized systems,
    to address the computational overhead associated with full-system diagonalization.
    We demonstrate that, from a certain dimension (≈104 basis functions) on, our submatrix
    method reduces the overall computational cost while maintaining acceptable numerical
    accuracy. Our study demonstrates the significance of the interplay between modern
    hardware, algorithmic considerations, and novel tight-binding methods, paving
    the way for further development in this direction.'
article_number: '132501'
author:
- first_name: Abylay
  full_name: Katbashev, Abylay
  last_name: Katbashev
- first_name: Robert
  full_name: Schade, Robert
  id: '75963'
  last_name: Schade
  orcid: 0000-0002-6268-5397
- first_name: Michael
  full_name: Laß, Michael
  id: '24135'
  last_name: Laß
  orcid: 0000-0002-5708-7632
- first_name: Marcel
  full_name: Müller, Marcel
  last_name: Müller
- first_name: Stefan
  full_name: Grimme, Stefan
  last_name: Grimme
- first_name: Andreas
  full_name: Hansen, Andreas
  last_name: Hansen
- first_name: Thomas
  full_name: Kühne, Thomas
  id: '49079'
  last_name: Kühne
citation:
  ama: Katbashev A, Schade R, Laß M, et al. Submatrix and GPU-accelerated implementation
    of density matrix tight-binding. <i>The Journal of Chemical Physics</i>. 2025;163(13).
    doi:<a href="https://doi.org/10.1063/5.0271379">10.1063/5.0271379</a>
  apa: Katbashev, A., Schade, R., Laß, M., Müller, M., Grimme, S., Hansen, A., &#38;
    Kühne, T. (2025). Submatrix and GPU-accelerated implementation of density matrix
    tight-binding. <i>The Journal of Chemical Physics</i>, <i>163</i>(13), Article
    132501. <a href="https://doi.org/10.1063/5.0271379">https://doi.org/10.1063/5.0271379</a>
  bibtex: '@article{Katbashev_Schade_Laß_Müller_Grimme_Hansen_Kühne_2025, title={Submatrix
    and GPU-accelerated implementation of density matrix tight-binding}, volume={163},
    DOI={<a href="https://doi.org/10.1063/5.0271379">10.1063/5.0271379</a>}, 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} }'
  chicago: Katbashev, Abylay, Robert Schade, Michael Laß, Marcel Müller, Stefan Grimme,
    Andreas Hansen, and Thomas Kühne. “Submatrix and GPU-Accelerated Implementation
    of Density Matrix Tight-Binding.” <i>The Journal of Chemical Physics</i> 163,
    no. 13 (2025). <a href="https://doi.org/10.1063/5.0271379">https://doi.org/10.1063/5.0271379</a>.
  ieee: 'A. Katbashev <i>et al.</i>, “Submatrix and GPU-accelerated implementation
    of density matrix tight-binding,” <i>The Journal of Chemical Physics</i>, vol.
    163, no. 13, Art. no. 132501, 2025, doi: <a href="https://doi.org/10.1063/5.0271379">10.1063/5.0271379</a>.'
  mla: Katbashev, Abylay, et al. “Submatrix and GPU-Accelerated Implementation of
    Density Matrix Tight-Binding.” <i>The Journal of Chemical Physics</i>, vol. 163,
    no. 13, 132501, AIP Publishing, 2025, doi:<a href="https://doi.org/10.1063/5.0271379">10.1063/5.0271379</a>.
  short: A. Katbashev, R. Schade, M. Laß, M. Müller, S. Grimme, A. Hansen, T. Kühne,
    The Journal of Chemical Physics 163 (2025).
date_created: 2025-11-01T00:41:50Z
date_updated: 2025-11-01T00:43:19Z
department:
- _id: '27'
doi: 10.1063/5.0271379
intvolume: '       163'
issue: '13'
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: The Journal of Chemical Physics
publication_identifier:
  issn:
  - 0021-9606
  - 1089-7690
publication_status: published
publisher: AIP Publishing
status: public
title: Submatrix and GPU-accelerated implementation of density matrix tight-binding
type: journal_article
user_id: '75963'
volume: 163
year: '2025'
...
---
_id: '62064'
abstract:
- lang: eng
  text: SYCL is an open standard for targeting heterogeneous hardware from C++. In
    this work, we evaluate a SYCL implementation for a discontinuous Galerkin discretization
    of the 2D shallow water equations targeting CPUs, GPUs, and also FPGAs. The discretization
    uses polynomial orders zero to two on unstructured triangular meshes. Separating
    memory accesses from the numerical code allow us to optimize data accesses for
    the target architecture. A performance analysis shows good portability across
    x86 and ARM CPUs, GPUs from different vendors, and even two variants of Intel
    Stratix 10 FPGAs. Measuring the energy to solution shows that GPUs yield an up
    to 10x higher energy efficiency in terms of degrees of freedom per joule compared
    to CPUs. With custom designed caches, FPGAs offer a meaningful complement to the
    other architectures with particularly good computational performance on smaller
    meshes. FPGAs with High Bandwidth Memory are less affected by bandwidth issues
    and have similar energy efficiency as latest generation CPUs.
article_number: '772'
author:
- first_name: Markus
  full_name: Büttner, Markus
  last_name: Büttner
- first_name: Christoph
  full_name: Alt, Christoph
  id: '100625'
  last_name: Alt
- first_name: Tobias
  full_name: Kenter, Tobias
  id: '3145'
  last_name: Kenter
- first_name: Harald
  full_name: Köstler, Harald
  last_name: Köstler
- first_name: Christian
  full_name: Plessl, Christian
  id: '16153'
  last_name: Plessl
  orcid: 0000-0001-5728-9982
- first_name: Vadym
  full_name: Aizinger, Vadym
  last_name: Aizinger
citation:
  ama: Büttner M, Alt C, Kenter T, Köstler H, Plessl C, Aizinger V. Analyzing performance
    portability for a SYCL implementation of the 2D shallow water equations. <i>The
    Journal of Supercomputing</i>. 2025;81(6). doi:<a href="https://doi.org/10.1007/s11227-025-07063-7">10.1007/s11227-025-07063-7</a>
  apa: Büttner, M., Alt, C., Kenter, T., Köstler, H., Plessl, C., &#38; Aizinger,
    V. (2025). Analyzing performance portability for a SYCL implementation of the
    2D shallow water equations. <i>The Journal of Supercomputing</i>, <i>81</i>(6),
    Article 772. <a href="https://doi.org/10.1007/s11227-025-07063-7">https://doi.org/10.1007/s11227-025-07063-7</a>
  bibtex: '@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={<a href="https://doi.org/10.1007/s11227-025-07063-7">10.1007/s11227-025-07063-7</a>},
    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}
    }'
  chicago: Büttner, Markus, Christoph Alt, Tobias Kenter, Harald Köstler, Christian
    Plessl, and Vadym Aizinger. “Analyzing Performance Portability for a SYCL Implementation
    of the 2D Shallow Water Equations.” <i>The Journal of Supercomputing</i> 81, no.
    6 (2025). <a href="https://doi.org/10.1007/s11227-025-07063-7">https://doi.org/10.1007/s11227-025-07063-7</a>.
  ieee: 'M. Büttner, C. Alt, T. Kenter, H. Köstler, C. Plessl, and V. Aizinger, “Analyzing
    performance portability for a SYCL implementation of the 2D shallow water equations,”
    <i>The Journal of Supercomputing</i>, vol. 81, no. 6, Art. no. 772, 2025, doi:
    <a href="https://doi.org/10.1007/s11227-025-07063-7">10.1007/s11227-025-07063-7</a>.'
  mla: Büttner, Markus, et al. “Analyzing Performance Portability for a SYCL Implementation
    of the 2D Shallow Water Equations.” <i>The Journal of Supercomputing</i>, vol.
    81, no. 6, 772, Springer Science and Business Media LLC, 2025, doi:<a href="https://doi.org/10.1007/s11227-025-07063-7">10.1007/s11227-025-07063-7</a>.
  short: M. Büttner, C. Alt, T. Kenter, H. Köstler, C. Plessl, V. Aizinger, The Journal
    of Supercomputing 81 (2025).
date_created: 2025-11-04T09:37:50Z
date_updated: 2025-11-04T09:48:10Z
department:
- _id: '27'
- _id: '518'
doi: 10.1007/s11227-025-07063-7
intvolume: '        81'
issue: '6'
language:
- iso: eng
main_file_link:
- open_access: '1'
oa: '1'
publication: The Journal of Supercomputing
publication_identifier:
  issn:
  - 1573-0484
publication_status: published
publisher: Springer Science and Business Media LLC
quality_controlled: '1'
status: public
title: Analyzing performance portability for a SYCL implementation of the 2D shallow
  water equations
type: journal_article
user_id: '3145'
volume: 81
year: '2025'
...
---
_id: '62066'
abstract:
- lang: eng
  text: In the context of high-performance computing (HPC) for distributed workloads,
    individual field-programmable gate arrays (FPGAs) need efficient ways to exchange
    data, which requires network infrastructure and software abstractions. Dedicated
    multi-FPGA clusters provide inter-FPGA networks for direct device to device communication.
    The oneAPI high-level synthesis toolchain offers I/O pipes to allow user kernels
    to interact with the networking ports of the FPGA board. In this work, we evaluate
    using oneAPI I/O pipes for direct FPGA-to-FPGA communication by scaling a SYCL
    implementation of a Jacobi solver on up to 25 FPGAs in the Noctua 2 cluster. We
    see good results in weak and strong scaling experiments.
author:
- first_name: Christoph
  full_name: Alt, Christoph
  id: '100625'
  last_name: Alt
- first_name: Christian
  full_name: Plessl, Christian
  id: '16153'
  last_name: Plessl
  orcid: 0000-0001-5728-9982
- first_name: Tobias
  full_name: Kenter, Tobias
  id: '3145'
  last_name: Kenter
citation:
  ama: 'Alt C, Plessl C, Kenter T. Evaluating oneAPI I/O Pipes in a Case Study of
    Scaling a SYCL Jacobi Solver to multiple FPGAs. In: <i>Proceedings of the 13th
    International Workshop on OpenCL and SYCL</i>. IWOCL ’25. Association for Computing
    Machinery; 2025. doi:<a href="https://doi.org/10.1145/3731125.3731131">10.1145/3731125.3731131</a>'
  apa: Alt, C., Plessl, C., &#38; Kenter, T. (2025). Evaluating oneAPI I/O Pipes in
    a Case Study of Scaling a SYCL Jacobi Solver to multiple FPGAs. <i>Proceedings
    of the 13th International Workshop on OpenCL and SYCL</i>. <a href="https://doi.org/10.1145/3731125.3731131">https://doi.org/10.1145/3731125.3731131</a>
  bibtex: '@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={<a href="https://doi.org/10.1145/3731125.3731131">10.1145/3731125.3731131</a>},
    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} }'
  chicago: 'Alt, Christoph, Christian Plessl, and Tobias Kenter. “Evaluating OneAPI
    I/O Pipes in a Case Study of Scaling a SYCL Jacobi Solver to Multiple FPGAs.”
    In <i>Proceedings of the 13th International Workshop on OpenCL and SYCL</i>. IWOCL
    ’25. New York, NY, USA: Association for Computing Machinery, 2025. <a href="https://doi.org/10.1145/3731125.3731131">https://doi.org/10.1145/3731125.3731131</a>.'
  ieee: 'C. Alt, C. Plessl, and T. Kenter, “Evaluating oneAPI I/O Pipes in a Case
    Study of Scaling a SYCL Jacobi Solver to multiple FPGAs,” 2025, doi: <a href="https://doi.org/10.1145/3731125.3731131">10.1145/3731125.3731131</a>.'
  mla: Alt, Christoph, et al. “Evaluating OneAPI I/O Pipes in a Case Study of Scaling
    a SYCL Jacobi Solver to Multiple FPGAs.” <i>Proceedings of the 13th International
    Workshop on OpenCL and SYCL</i>, Association for Computing Machinery, 2025, doi:<a
    href="https://doi.org/10.1145/3731125.3731131">10.1145/3731125.3731131</a>.
  short: 'C. Alt, C. Plessl, T. Kenter, in: Proceedings of the 13th International
    Workshop on OpenCL and SYCL, Association for Computing Machinery, New York, NY,
    USA, 2025.'
date_created: 2025-11-04T09:45:23Z
date_updated: 2025-11-04T09:47:26Z
department:
- _id: '27'
- _id: '518'
doi: 10.1145/3731125.3731131
keyword:
- Multi-FPGA
- High-level Synthesis
- oneAPI
- FPGA
language:
- iso: eng
main_file_link:
- open_access: '1'
oa: '1'
place: New York, NY, USA
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Proceedings of the 13th International Workshop on OpenCL and SYCL
publication_identifier:
  isbn:
  - '9798400713606'
publisher: Association for Computing Machinery
quality_controlled: '1'
series_title: IWOCL ’25
status: public
title: Evaluating oneAPI I/O Pipes in a Case Study of Scaling a SYCL Jacobi Solver
  to multiple FPGAs
type: conference
user_id: '3145'
year: '2025'
...
---
_id: '62065'
author:
- first_name: Shivam
  full_name: Sundriyal, Shivam
  last_name: Sundriyal
- first_name: Markus
  full_name: Büttner, Markus
  last_name: Büttner
- first_name: Christoph
  full_name: Alt, Christoph
  id: '100625'
  last_name: Alt
- first_name: Tobias
  full_name: Kenter, Tobias
  id: '3145'
  last_name: Kenter
- first_name: Vadym
  full_name: Aizinger, Vadym
  last_name: Aizinger
citation:
  ama: 'Sundriyal S, Büttner M, Alt C, Kenter T, Aizinger V. Adaptive Spectral Block
    Floating Point for Discontinuous Galerkin Methods. In: <i>2025 IEEE High Performance
    Extreme Computing Conference (HPEC)</i>. IEEE; 2025. doi:<a href="https://doi.org/10.1109/hpec67600.2025.11196195">10.1109/hpec67600.2025.11196195</a>'
  apa: Sundriyal, S., Büttner, M., Alt, C., Kenter, T., &#38; Aizinger, V. (2025).
    Adaptive Spectral Block Floating Point for Discontinuous Galerkin Methods. <i>2025
    IEEE High Performance Extreme Computing Conference (HPEC)</i>. <a href="https://doi.org/10.1109/hpec67600.2025.11196195">https://doi.org/10.1109/hpec67600.2025.11196195</a>
  bibtex: '@inproceedings{Sundriyal_Büttner_Alt_Kenter_Aizinger_2025, title={Adaptive
    Spectral Block Floating Point for Discontinuous Galerkin Methods}, DOI={<a href="https://doi.org/10.1109/hpec67600.2025.11196195">10.1109/hpec67600.2025.11196195</a>},
    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} }'
  chicago: Sundriyal, Shivam, Markus Büttner, Christoph Alt, Tobias Kenter, and Vadym
    Aizinger. “Adaptive Spectral Block Floating Point for Discontinuous Galerkin Methods.”
    In <i>2025 IEEE High Performance Extreme Computing Conference (HPEC)</i>. IEEE,
    2025. <a href="https://doi.org/10.1109/hpec67600.2025.11196195">https://doi.org/10.1109/hpec67600.2025.11196195</a>.
  ieee: 'S. Sundriyal, M. Büttner, C. Alt, T. Kenter, and V. Aizinger, “Adaptive Spectral
    Block Floating Point for Discontinuous Galerkin Methods,” 2025, doi: <a href="https://doi.org/10.1109/hpec67600.2025.11196195">10.1109/hpec67600.2025.11196195</a>.'
  mla: Sundriyal, Shivam, et al. “Adaptive Spectral Block Floating Point for Discontinuous
    Galerkin Methods.” <i>2025 IEEE High Performance Extreme Computing Conference
    (HPEC)</i>, IEEE, 2025, doi:<a href="https://doi.org/10.1109/hpec67600.2025.11196195">10.1109/hpec67600.2025.11196195</a>.
  short: 'S. Sundriyal, M. Büttner, C. Alt, T. Kenter, V. Aizinger, in: 2025 IEEE
    High Performance Extreme Computing Conference (HPEC), IEEE, 2025.'
date_created: 2025-11-04T09:43:18Z
date_updated: 2025-11-04T09:48:46Z
department:
- _id: '27'
- _id: '518'
doi: 10.1109/hpec67600.2025.11196195
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: 2025 IEEE High Performance Extreme Computing Conference (HPEC)
publication_status: published
publisher: IEEE
quality_controlled: '1'
status: public
title: Adaptive Spectral Block Floating Point for Discontinuous Galerkin Methods
type: conference
user_id: '3145'
year: '2025'
...
---
_id: '62166'
article_number: '131758'
author:
- first_name: Tim
  full_name: Prüßner, Tim
  last_name: Prüßner
- first_name: Kay-Peter
  full_name: Hoyer, Kay-Peter
  id: '48411'
  last_name: Hoyer
- first_name: Nadine
  full_name: Buitkamp, Nadine
  id: '1449'
  last_name: Buitkamp
- first_name: Pascal
  full_name: Vieth, Pascal
  last_name: Vieth
- first_name: Guido
  full_name: Grundmeier, Guido
  id: '194'
  last_name: Grundmeier
citation:
  ama: Prüßner T, Hoyer K-P, Buitkamp N, Vieth P, Grundmeier G. Surface functionalisation
    of additively manufactured AlSi10Mg by organophosphonic acid and PDMS grafting.
    <i>Materials Chemistry and Physics</i>. 2025;349. doi:<a href="https://doi.org/10.1016/j.matchemphys.2025.131758">10.1016/j.matchemphys.2025.131758</a>
  apa: Prüßner, T., Hoyer, K.-P., Buitkamp, N., Vieth, P., &#38; Grundmeier, G. (2025).
    Surface functionalisation of additively manufactured AlSi10Mg by organophosphonic
    acid and PDMS grafting. <i>Materials Chemistry and Physics</i>, <i>349</i>, Article
    131758. <a href="https://doi.org/10.1016/j.matchemphys.2025.131758">https://doi.org/10.1016/j.matchemphys.2025.131758</a>
  bibtex: '@article{Prüßner_Hoyer_Buitkamp_Vieth_Grundmeier_2025, title={Surface functionalisation
    of additively manufactured AlSi10Mg by organophosphonic acid and PDMS grafting},
    volume={349}, DOI={<a href="https://doi.org/10.1016/j.matchemphys.2025.131758">10.1016/j.matchemphys.2025.131758</a>},
    number={131758}, journal={Materials Chemistry and Physics}, publisher={Elsevier
    BV}, author={Prüßner, Tim and Hoyer, Kay-Peter and Buitkamp, Nadine and Vieth,
    Pascal and Grundmeier, Guido}, year={2025} }'
  chicago: Prüßner, Tim, Kay-Peter Hoyer, Nadine Buitkamp, Pascal Vieth, and Guido
    Grundmeier. “Surface Functionalisation of Additively Manufactured AlSi10Mg by
    Organophosphonic Acid and PDMS Grafting.” <i>Materials Chemistry and Physics</i>
    349 (2025). <a href="https://doi.org/10.1016/j.matchemphys.2025.131758">https://doi.org/10.1016/j.matchemphys.2025.131758</a>.
  ieee: 'T. Prüßner, K.-P. Hoyer, N. Buitkamp, P. Vieth, and G. Grundmeier, “Surface
    functionalisation of additively manufactured AlSi10Mg by organophosphonic acid
    and PDMS grafting,” <i>Materials Chemistry and Physics</i>, vol. 349, Art. no.
    131758, 2025, doi: <a href="https://doi.org/10.1016/j.matchemphys.2025.131758">10.1016/j.matchemphys.2025.131758</a>.'
  mla: Prüßner, Tim, et al. “Surface Functionalisation of Additively Manufactured
    AlSi10Mg by Organophosphonic Acid and PDMS Grafting.” <i>Materials Chemistry and
    Physics</i>, vol. 349, 131758, Elsevier BV, 2025, doi:<a href="https://doi.org/10.1016/j.matchemphys.2025.131758">10.1016/j.matchemphys.2025.131758</a>.
  short: T. Prüßner, K.-P. Hoyer, N. Buitkamp, P. Vieth, G. Grundmeier, Materials
    Chemistry and Physics 349 (2025).
date_created: 2025-11-12T07:33:04Z
date_updated: 2025-11-12T07:34:26Z
department:
- _id: '9'
- _id: '158'
- _id: '321'
doi: 10.1016/j.matchemphys.2025.131758
intvolume: '       349'
language:
- iso: eng
publication: Materials Chemistry and Physics
publication_identifier:
  issn:
  - 0254-0584
publication_status: published
publisher: Elsevier BV
quality_controlled: '1'
status: public
title: Surface functionalisation of additively manufactured AlSi10Mg by organophosphonic
  acid and PDMS grafting
type: journal_article
user_id: '48411'
volume: 349
year: '2025'
...
---
_id: '62181'
abstract:
- lang: eng
  text: <jats:p>This research investigates how Artificial Intelligence (AI) can be
    systematically integrated into existing business processes by combining suitable
    competencies with graphical AI workflow modelling. While AI offers a high potential
    for automation and increased efficiency, its implementation often fails due to
    a lack of interdisciplinary competencies that bridge the gap between domain expertise
    and IT know-how. Low-code platforms and visual modelling tools are increasingly
    recognised as enablers, empowering non-programmers to intuitively create graphical
    AI- based workflows. Nevertheless, specific competencies are required to realise
    the full potential of AI, the domain specific knowledge and align technical understanding
    with AI capabilities. The paper reviews the state of the art in AI-driven business
    process automation and competencies for visual low-code approaches. It then presents
    a practical solution to identify and systematise essential competence areas. Based
    on this, a practical competence model is developed to support the design of user-friendly,
    AI-enabled workflows. This is tested in a practical application context — emergency
    management — where it supports critical decision-making processes and is validated
    through expert feedback. The study concludes by offering actionable recommendations
    to help organisations foster the necessary competencies and methods for competently
    integrating AI into their digital processes.</jats:p>
author:
- first_name: Iris
  full_name: Gräßler, Iris
  id: '47565'
  last_name: Gräßler
  orcid: 0000-0001-5765-971X
- first_name: Deniz
  full_name: Özcan, Deniz
  id: '58595'
  last_name: Özcan
citation:
  ama: 'Gräßler I, Özcan D. Graphical AI workflow modelling: Identifying relevant
    competencies in AI-based automation of business processes. In: <i>AHFE International</i>.
    Vol 198. AHFE International; 2025. doi:<a href="https://doi.org/10.54941/ahfe1006785">10.54941/ahfe1006785</a>'
  apa: 'Gräßler, I., &#38; Özcan, D. (2025). Graphical AI workflow modelling: Identifying
    relevant competencies in AI-based automation of business processes. <i>AHFE International</i>,
    <i>198</i>. <a href="https://doi.org/10.54941/ahfe1006785">https://doi.org/10.54941/ahfe1006785</a>'
  bibtex: '@inproceedings{Gräßler_Özcan_2025, title={Graphical AI workflow modelling:
    Identifying relevant competencies in AI-based automation of business processes},
    volume={198}, DOI={<a href="https://doi.org/10.54941/ahfe1006785">10.54941/ahfe1006785</a>},
    booktitle={AHFE International}, publisher={AHFE International}, author={Gräßler,
    Iris and Özcan, Deniz}, year={2025} }'
  chicago: 'Gräßler, Iris, and Deniz Özcan. “Graphical AI Workflow Modelling: Identifying
    Relevant Competencies in AI-Based Automation of Business Processes.” In <i>AHFE
    International</i>, Vol. 198. AHFE International, 2025. <a href="https://doi.org/10.54941/ahfe1006785">https://doi.org/10.54941/ahfe1006785</a>.'
  ieee: 'I. Gräßler and D. Özcan, “Graphical AI workflow modelling: Identifying relevant
    competencies in AI-based automation of business processes,” in <i>AHFE International</i>,
    Split, 2025, vol. 198, doi: <a href="https://doi.org/10.54941/ahfe1006785">10.54941/ahfe1006785</a>.'
  mla: 'Gräßler, Iris, and Deniz Özcan. “Graphical AI Workflow Modelling: Identifying
    Relevant Competencies in AI-Based Automation of Business Processes.” <i>AHFE International</i>,
    vol. 198, AHFE International, 2025, doi:<a href="https://doi.org/10.54941/ahfe1006785">10.54941/ahfe1006785</a>.'
  short: 'I. Gräßler, D. Özcan, in: AHFE International, AHFE International, 2025.'
conference:
  end_date: 2025-09-24
  location: Split
  name: '7th International Conference on Human Systems Engineering and Design: Future
    Trends and Applications (IHSED 2025)'
  start_date: 2025-09-22
date_created: 2025-11-13T16:37:59Z
date_updated: 2025-11-13T16:41:39Z
department:
- _id: '43'
- _id: '9'
- _id: '26'
- _id: '152'
doi: 10.54941/ahfe1006785
intvolume: '       198'
language:
- iso: eng
publication: AHFE International
publication_identifier:
  issn:
  - 2771-0718
publication_status: published
publisher: AHFE International
quality_controlled: '1'
status: public
title: 'Graphical AI workflow modelling: Identifying relevant competencies in AI-based
  automation of business processes'
type: conference
user_id: '58595'
volume: 198
year: '2025'
...
---
_id: '62182'
abstract:
- lang: eng
  text: '<p> Executive summary Die vorliegende Zukunftsstudie „Automation 2035“ gibt
    einen Ausblick auf die Entwicklung der Automatisierungstechnik in den nächsten
    10 Jahren. Neben der Beschreibung von Trends wie Kreislaufwirtschaft, Automatisierung
    der Märkte, Biologisierung, autonome Systeme und Robotik sowie IT-Sicherheit wird
    die zu erwartende Veränderung in der Bildung beschrieben. Dazu verwenden wir Methoden
    der Zukunftsforschung und arbeiten mit der Szenarientechnik, um Zukunftsperspektiven
    der Automation aufzuzeigen. Personas werden eingesetzt, um die zukünftigen Entwicklungen
    plastisch aus den Augen der Personen im Jahr 2025 und in der Zukunft im Jahr 2035
    zu beschreiben. Schlüsselthemen und Trends: ... ... Inhalt Executive summary 1
    1 Einführung 3 2 Zukunftsfelder für die Automatisierungstechnik 2035 4 2.1 Kreislaufwirtschaft
    4 2.2 Automatisierung der Märkte 7 2.3 Biologisierung 8 2.4 Autonome Systeme und
    Robotik 10 2.5 Security 12 2.6 Veränderung der Ausbildung 13 3 Szenario der Automation
    2035 16 4 Personas 18 4.1 Unternehmer 18 4.2 Ingenieurin 19 4.3 Schüler 20 5 Thesen
    und Ausblick 22 Methodik 24 Autorenteam 25 Schrifttum 26... </p>'
alternative_title:
- VDI-Studie
author:
- first_name: Iris
  full_name: Gräßler, Iris
  id: '47565'
  last_name: Gräßler
  orcid: 0000-0001-5765-971X
- first_name: Deniz
  full_name: Özcan, Deniz
  id: '58595'
  last_name: Özcan
- first_name: Alena Marie
  full_name: Tusek, Alena Marie
  id: '59370'
  last_name: Tusek
- first_name: Attila
  full_name: Bilgic, Attila
  last_name: Bilgic
- first_name: Christian
  full_name: Lange, Christian
  last_name: Lange
- first_name: Christian
  full_name: Stich, Christian
  last_name: Stich
- first_name: Christine
  full_name: Maul, Christine
  last_name: Maul
- first_name: Michael
  full_name: Heizmann, Michael
  last_name: Heizmann
- first_name: Michael
  full_name: Weyrich, Michael
  last_name: Weyrich
- first_name: Sascha
  full_name: Dessel,, Sascha
  last_name: Dessel,
- first_name: Torben
  full_name: Miny, Torben
  last_name: Miny
- first_name: Ulrich
  full_name: Jumar, Ulrich
  last_name: Jumar
citation:
  ama: Gräßler I, Özcan D, Tusek AM, et al. <i>Automation 2035</i>. VDI Verlag; 2025.
    doi:<a href="https://doi.org/10.51202/9783911670180">10.51202/9783911670180</a>
  apa: Gräßler, I., Özcan, D., Tusek, A. M., Bilgic, A., Lange, C., Stich, C., Maul,
    C., Heizmann, M., Weyrich, M., Dessel, S., Miny, T., &#38; Jumar, U. (2025). <i>Automation
    2035</i>. VDI Verlag. <a href="https://doi.org/10.51202/9783911670180">https://doi.org/10.51202/9783911670180</a>
  bibtex: '@book{Gräßler_Özcan_Tusek_Bilgic_Lange_Stich_Maul_Heizmann_Weyrich_Dessel,_et
    al._2025, title={Automation 2035}, DOI={<a href="https://doi.org/10.51202/9783911670180">10.51202/9783911670180</a>},
    publisher={VDI Verlag}, author={Gräßler, Iris and Özcan, Deniz and Tusek, Alena
    Marie and Bilgic, Attila and Lange, Christian and Stich, Christian and Maul, Christine
    and Heizmann, Michael and Weyrich, Michael and Dessel, Sascha and et al.}, year={2025}
    }'
  chicago: Gräßler, Iris, Deniz Özcan, Alena Marie Tusek, Attila Bilgic, Christian
    Lange, Christian Stich, Christine Maul, et al. <i>Automation 2035</i>. VDI Verlag,
    2025. <a href="https://doi.org/10.51202/9783911670180">https://doi.org/10.51202/9783911670180</a>.
  ieee: I. Gräßler <i>et al.</i>, <i>Automation 2035</i>. VDI Verlag, 2025.
  mla: Gräßler, Iris, et al. <i>Automation 2035</i>. VDI Verlag, 2025, doi:<a href="https://doi.org/10.51202/9783911670180">10.51202/9783911670180</a>.
  short: I. Gräßler, D. Özcan, A.M. Tusek, A. Bilgic, C. Lange, C. Stich, C. Maul,
    M. Heizmann, M. Weyrich, S. Dessel, T. Miny, U. Jumar, Automation 2035, VDI Verlag,
    2025.
date_created: 2025-11-13T16:43:05Z
date_updated: 2025-11-13T16:48:43Z
department:
- _id: '43'
- _id: '9'
- _id: '26'
- _id: '152'
doi: 10.51202/9783911670180
language:
- iso: eng
publication_identifier:
  isbn:
  - '9783911670180'
publication_status: published
publisher: VDI Verlag
quality_controlled: '1'
status: public
title: Automation 2035
type: book
user_id: '58595'
year: '2025'
...
---
_id: '61517'
author:
- first_name: Suzana
  full_name: Alpsancar, Suzana
  id: '93637'
  last_name: Alpsancar
citation:
  ama: 'Alpsancar S. Algorithmische Kulturen des Pflanzensammelns? Das Beispiel der
    Computerisierung des Botanischen Gartens und Botanischen Museums Berlin. In: Hashagen
    U, Seising R, eds. <i>Algorithmische Wissenskulturen. Der Einfluss des Computers
    auf die Wissenschaftsentwicklung</i>. Die blaue Stunde der Informatik. Springer;
    2025:327–365. doi:<a href="https://doi.org/10.1007/978-3-658-35560-9_14">10.1007/978-3-658-35560-9_14</a>'
  apa: Alpsancar, S. (2025). Algorithmische Kulturen des Pflanzensammelns? Das Beispiel
    der Computerisierung des Botanischen Gartens und Botanischen Museums Berlin. In
    U. Hashagen &#38; R. Seising (Eds.), <i>Algorithmische Wissenskulturen. Der Einfluss
    des Computers auf die Wissenschaftsentwicklung</i> (pp. 327–365). Springer. <a
    href="https://doi.org/10.1007/978-3-658-35560-9_14">https://doi.org/10.1007/978-3-658-35560-9_14</a>
  bibtex: '@inbook{Alpsancar_2025, place={Wiesbaden}, series={Die blaue Stunde der
    Informatik}, title={Algorithmische Kulturen des Pflanzensammelns? Das Beispiel
    der Computerisierung des Botanischen Gartens und Botanischen Museums Berlin},
    DOI={<a href="https://doi.org/10.1007/978-3-658-35560-9_14">10.1007/978-3-658-35560-9_14</a>},
    booktitle={Algorithmische Wissenskulturen. Der Einfluss des Computers auf die
    Wissenschaftsentwicklung}, publisher={Springer}, author={Alpsancar, Suzana}, editor={Hashagen,
    Ulf and Seising, Rudolf}, year={2025}, pages={327–365}, collection={Die blaue
    Stunde der Informatik} }'
  chicago: 'Alpsancar, Suzana. “Algorithmische Kulturen des Pflanzensammelns? Das
    Beispiel der Computerisierung des Botanischen Gartens und Botanischen Museums
    Berlin.” In <i>Algorithmische Wissenskulturen. Der Einfluss des Computers auf
    die Wissenschaftsentwicklung</i>, edited by Ulf Hashagen and Rudolf Seising, 327–365.
    Die blaue Stunde der Informatik. Wiesbaden: Springer, 2025. <a href="https://doi.org/10.1007/978-3-658-35560-9_14">https://doi.org/10.1007/978-3-658-35560-9_14</a>.'
  ieee: 'S. Alpsancar, “Algorithmische Kulturen des Pflanzensammelns? Das Beispiel
    der Computerisierung des Botanischen Gartens und Botanischen Museums Berlin,”
    in <i>Algorithmische Wissenskulturen. Der Einfluss des Computers auf die Wissenschaftsentwicklung</i>,
    U. Hashagen and R. Seising, Eds. Wiesbaden: Springer, 2025, pp. 327–365.'
  mla: Alpsancar, Suzana. “Algorithmische Kulturen des Pflanzensammelns? Das Beispiel
    der Computerisierung des Botanischen Gartens und Botanischen Museums Berlin.”
    <i>Algorithmische Wissenskulturen. Der Einfluss des Computers auf die Wissenschaftsentwicklung</i>,
    edited by Ulf Hashagen and Rudolf Seising, Springer, 2025, pp. 327–365, doi:<a
    href="https://doi.org/10.1007/978-3-658-35560-9_14">10.1007/978-3-658-35560-9_14</a>.
  short: 'S. Alpsancar, in: U. Hashagen, R. Seising (Eds.), Algorithmische Wissenskulturen.
    Der Einfluss des Computers auf die Wissenschaftsentwicklung, Springer, Wiesbaden,
    2025, pp. 327–365.'
date_created: 2025-10-05T15:29:31Z
date_updated: 2025-11-18T09:31:23Z
department:
- _id: '26'
- _id: '756'
doi: 10.1007/978-3-658-35560-9_14
editor:
- first_name: Ulf
  full_name: Hashagen, Ulf
  last_name: Hashagen
- first_name: Rudolf
  full_name: Seising, Rudolf
  last_name: Seising
language:
- iso: ger
page: 327–365
place: Wiesbaden
publication: Algorithmische Wissenskulturen. Der Einfluss des Computers auf die Wissenschaftsentwicklung
publication_identifier:
  isbn:
  - '9783658355593'
  - '9783658355609'
  issn:
  - 2730-7425
  - 2730-7433
publication_status: published
publisher: Springer
series_title: Die blaue Stunde der Informatik
status: public
title: Algorithmische Kulturen des Pflanzensammelns? Das Beispiel der Computerisierung
  des Botanischen Gartens und Botanischen Museums Berlin
type: book_chapter
user_id: '93637'
year: '2025'
...
