---
_id: '238'
abstract:
- lang: eng
  text: In this paper, we study how binary applications can be transparently accelerated
    with novel heterogeneous computing resources without requiring any manual porting
    or developer-provided hints. Our work is based on Binary Acceleration At Runtime
    (BAAR), our previously introduced binary acceleration mechanism that uses the
    LLVM Compiler Infrastructure. BAAR is designed as a client-server architecture.
    The client runs the program to be accelerated in an environment, which allows
    program analysis and profiling and identifies and extracts suitable program parts
    to be offloaded. The server compiles and optimizes these offloaded program parts
    for the accelerator and offers access to these functions to the client with a
    remote procedure call (RPC) interface. Our previous work proved the feasibility
    of our approach, but also showed that communication time and overheads limit the
    granularity of functions that can be meaningfully offloaded. In this work, we
    motivate the importance of a lightweight, high-performance communication between
    server and client and present a communication mechanism based on the Message Passing
    Interface (MPI). We evaluate our approach by using an Intel Xeon Phi 5110P as
    the acceleration target and show that the communication overhead can be reduced
    from 40% to 10%, thus enabling even small hotspots to benefit from offloading
    to an accelerator.
author:
- first_name: Marvin
  full_name: Damschen, Marvin
  last_name: Damschen
- first_name: Heinrich
  full_name: Riebler, Heinrich
  id: '8961'
  last_name: Riebler
- first_name: Gavin Francis
  full_name: Vaz, Gavin Francis
  id: '30332'
  last_name: Vaz
- first_name: Christian
  full_name: Plessl, Christian
  id: '16153'
  last_name: Plessl
  orcid: 0000-0001-5728-9982
citation:
  ama: 'Damschen M, Riebler H, Vaz GF, Plessl C. Transparent offloading of computational
    hotspots from binary code to Xeon Phi. In: <i>Proceedings of the 2015 Conference
    on Design, Automation and Test in Europe (DATE)</i>. EDA Consortium / IEEE; 2015:1078-1083.
    doi:<a href="https://doi.org/10.7873/DATE.2015.1124">10.7873/DATE.2015.1124</a>'
  apa: Damschen, M., Riebler, H., Vaz, G. F., &#38; Plessl, C. (2015). Transparent
    offloading of computational hotspots from binary code to Xeon Phi. <i>Proceedings
    of the 2015 Conference on Design, Automation and Test in Europe (DATE)</i>, 1078–1083.
    <a href="https://doi.org/10.7873/DATE.2015.1124">https://doi.org/10.7873/DATE.2015.1124</a>
  bibtex: '@inproceedings{Damschen_Riebler_Vaz_Plessl_2015, title={Transparent offloading
    of computational hotspots from binary code to Xeon Phi}, DOI={<a href="https://doi.org/10.7873/DATE.2015.1124">10.7873/DATE.2015.1124</a>},
    booktitle={Proceedings of the 2015 Conference on Design, Automation and Test in
    Europe (DATE)}, publisher={EDA Consortium / IEEE}, author={Damschen, Marvin and
    Riebler, Heinrich and Vaz, Gavin Francis and Plessl, Christian}, year={2015},
    pages={1078–1083} }'
  chicago: Damschen, Marvin, Heinrich Riebler, Gavin Francis Vaz, and Christian Plessl.
    “Transparent Offloading of Computational Hotspots from Binary Code to Xeon Phi.”
    In <i>Proceedings of the 2015 Conference on Design, Automation and Test in Europe
    (DATE)</i>, 1078–83. EDA Consortium / IEEE, 2015. <a href="https://doi.org/10.7873/DATE.2015.1124">https://doi.org/10.7873/DATE.2015.1124</a>.
  ieee: 'M. Damschen, H. Riebler, G. F. Vaz, and C. Plessl, “Transparent offloading
    of computational hotspots from binary code to Xeon Phi,” in <i>Proceedings of
    the 2015 Conference on Design, Automation and Test in Europe (DATE)</i>, 2015,
    pp. 1078–1083, doi: <a href="https://doi.org/10.7873/DATE.2015.1124">10.7873/DATE.2015.1124</a>.'
  mla: Damschen, Marvin, et al. “Transparent Offloading of Computational Hotspots
    from Binary Code to Xeon Phi.” <i>Proceedings of the 2015 Conference on Design,
    Automation and Test in Europe (DATE)</i>, EDA Consortium / IEEE, 2015, pp. 1078–83,
    doi:<a href="https://doi.org/10.7873/DATE.2015.1124">10.7873/DATE.2015.1124</a>.
  short: 'M. Damschen, H. Riebler, G.F. Vaz, C. Plessl, in: Proceedings of the 2015
    Conference on Design, Automation and Test in Europe (DATE), EDA Consortium / IEEE,
    2015, pp. 1078–1083.'
date_created: 2017-10-17T12:41:38Z
date_updated: 2023-09-26T13:31:44Z
ddc:
- '040'
department:
- _id: '27'
- _id: '518'
- _id: '78'
doi: 10.7873/DATE.2015.1124
file:
- access_level: closed
  content_type: application/pdf
  creator: florida
  date_created: 2018-03-21T10:29:49Z
  date_updated: 2018-03-21T10:29:49Z
  file_id: '1500'
  file_name: 238-plessl15_date.pdf
  file_size: 380552
  relation: main_file
  success: 1
file_date_updated: 2018-03-21T10:29:49Z
has_accepted_license: '1'
language:
- iso: eng
page: 1078-1083
project:
- _id: '1'
  grant_number: '160364472'
  name: SFB 901
- _id: '14'
  grant_number: '160364472'
  name: SFB 901 - Subprojekt C2
- _id: '4'
  name: SFB 901 - Project Area C
- _id: '34'
  grant_number: '610996'
  name: Self-Adaptive Virtualisation-Aware High-Performance/Low-Energy Heterogeneous
    System Architectures
publication: Proceedings of the 2015 Conference on Design, Automation and Test in
  Europe (DATE)
publisher: EDA Consortium / IEEE
quality_controlled: '1'
status: public
title: Transparent offloading of computational hotspots from binary code to Xeon Phi
type: conference
user_id: '15278'
year: '2015'
...
---
_id: '1775'
abstract:
- lang: eng
  text: The ATLAS experiment at CERN is planning full deployment of a new unified
    optical link technology for connecting detector front end electronics on the timescale
    of the LHC Run 4 (2025). It is estimated that roughly 8000 GBT (GigaBit Transceiver)
    links, with transfer rates up to 10.24 Gbps, will replace existing links used
    for readout, detector control and distribution of timing and trigger information.
    A new class of devices will be needed to interface many GBT links to the rest
    of the trigger, data-acquisition and detector control systems. In this paper FELIX
    (Front End LInk eXchange) is presented, a PC-based device to route data from and
    to multiple GBT links via a high-performance general purpose network capable of
    a total throughput up to O(20 Tbps). FELIX implies architectural changes to the
    ATLAS data acquisition system, such as the use of industry standard COTS components
    early in the DAQ chain. Additionally the design and implementation of a FELIX
    demonstration platform is presented and hardware and software aspects will be
    discussed.
article_number: '082050'
author:
- first_name: J
  full_name: Anderson, J
  last_name: Anderson
- first_name: A
  full_name: Borga, A
  last_name: Borga
- first_name: H
  full_name: Boterenbrood, H
  last_name: Boterenbrood
- first_name: H
  full_name: Chen, H
  last_name: Chen
- first_name: K
  full_name: Chen, K
  last_name: Chen
- first_name: G
  full_name: Drake, G
  last_name: Drake
- first_name: D
  full_name: Francis, D
  last_name: Francis
- first_name: B
  full_name: Gorini, B
  last_name: Gorini
- first_name: F
  full_name: Lanni, F
  last_name: Lanni
- first_name: G
  full_name: Lehmann Miotto, G
  last_name: Lehmann Miotto
- first_name: L
  full_name: Levinson, L
  last_name: Levinson
- first_name: J
  full_name: Narevicius, J
  last_name: Narevicius
- first_name: Christian
  full_name: Plessl, Christian
  id: '16153'
  last_name: Plessl
  orcid: 0000-0001-5728-9982
- first_name: A
  full_name: Roich, A
  last_name: Roich
- first_name: S
  full_name: Ryu, S
  last_name: Ryu
- first_name: F
  full_name: Schreuder, F
  last_name: Schreuder
- first_name: Jörn
  full_name: Schumacher, Jörn
  last_name: Schumacher
- first_name: Wainer
  full_name: Vandelli, Wainer
  last_name: Vandelli
- first_name: J
  full_name: Vermeulen, J
  last_name: Vermeulen
- first_name: J
  full_name: Zhang, J
  last_name: Zhang
citation:
  ama: 'Anderson J, Borga A, Boterenbrood H, et al. FELIX: a High-Throughput Network
    Approach for Interfacing to Front End Electronics for ATLAS Upgrades. <i>Journal
    of Physics: Conference Series</i>. 2015;664. doi:<a href="https://doi.org/10.1088/1742-6596/664/8/082050">10.1088/1742-6596/664/8/082050</a>'
  apa: 'Anderson, J., Borga, A., Boterenbrood, H., Chen, H., Chen, K., Drake, G.,
    Francis, D., Gorini, B., Lanni, F., Lehmann Miotto, G., Levinson, L., Narevicius,
    J., Plessl, C., Roich, A., Ryu, S., Schreuder, F., Schumacher, J., Vandelli, W.,
    Vermeulen, J., &#38; Zhang, J. (2015). FELIX: a High-Throughput Network Approach
    for Interfacing to Front End Electronics for ATLAS Upgrades. <i>Journal of Physics:
    Conference Series</i>, <i>664</i>, Article 082050. <a href="https://doi.org/10.1088/1742-6596/664/8/082050">https://doi.org/10.1088/1742-6596/664/8/082050</a>'
  bibtex: '@article{Anderson_Borga_Boterenbrood_Chen_Chen_Drake_Francis_Gorini_Lanni_Lehmann
    Miotto_et al._2015, title={FELIX: a High-Throughput Network Approach for Interfacing
    to Front End Electronics for ATLAS Upgrades}, volume={664}, DOI={<a href="https://doi.org/10.1088/1742-6596/664/8/082050">10.1088/1742-6596/664/8/082050</a>},
    number={082050}, journal={Journal of Physics: Conference Series}, publisher={IOP
    Publishing}, author={Anderson, J and Borga, A and Boterenbrood, H and Chen, H
    and Chen, K and Drake, G and Francis, D and Gorini, B and Lanni, F and Lehmann
    Miotto, G and et al.}, year={2015} }'
  chicago: 'Anderson, J, A Borga, H Boterenbrood, H Chen, K Chen, G Drake, D Francis,
    et al. “FELIX: A High-Throughput Network Approach for Interfacing to Front End
    Electronics for ATLAS Upgrades.” <i>Journal of Physics: Conference Series</i>
    664 (2015). <a href="https://doi.org/10.1088/1742-6596/664/8/082050">https://doi.org/10.1088/1742-6596/664/8/082050</a>.'
  ieee: 'J. Anderson <i>et al.</i>, “FELIX: a High-Throughput Network Approach for
    Interfacing to Front End Electronics for ATLAS Upgrades,” <i>Journal of Physics:
    Conference Series</i>, vol. 664, Art. no. 082050, 2015, doi: <a href="https://doi.org/10.1088/1742-6596/664/8/082050">10.1088/1742-6596/664/8/082050</a>.'
  mla: 'Anderson, J., et al. “FELIX: A High-Throughput Network Approach for Interfacing
    to Front End Electronics for ATLAS Upgrades.” <i>Journal of Physics: Conference
    Series</i>, vol. 664, 082050, IOP Publishing, 2015, doi:<a href="https://doi.org/10.1088/1742-6596/664/8/082050">10.1088/1742-6596/664/8/082050</a>.'
  short: 'J. Anderson, A. Borga, H. Boterenbrood, H. Chen, K. Chen, G. Drake, D. Francis,
    B. Gorini, F. Lanni, G. Lehmann Miotto, L. Levinson, J. Narevicius, C. Plessl,
    A. Roich, S. Ryu, F. Schreuder, J. Schumacher, W. Vandelli, J. Vermeulen, J. Zhang,
    Journal of Physics: Conference Series 664 (2015).'
date_created: 2018-03-23T14:19:27Z
date_updated: 2023-09-26T13:31:23Z
department:
- _id: '27'
- _id: '518'
doi: 10.1088/1742-6596/664/8/082050
intvolume: '       664'
language:
- iso: eng
publication: 'Journal of Physics: Conference Series'
publisher: IOP Publishing
quality_controlled: '1'
status: public
title: 'FELIX: a High-Throughput Network Approach for Interfacing to Front End Electronics
  for ATLAS Upgrades'
type: journal_article
user_id: '15278'
volume: 664
year: '2015'
...
---
_id: '10030'
abstract:
- lang: eng
  text: The vibrational properties of stoichiometric LiNbO3 are analyzed within density-functional
    perturbation theory in order to obtain the complete phonon dispersion of the material.
    The phonon density of states of the ferroelectric (paraelectric) phase shows two
    (one) distinct band gaps separating the high-frequency (~800 cm−1) optical branches
    from the continuum of acoustic and lower optical phonon states. This result leads
    to specific heat capacites in close agreement with experimental measurements in
    the range 0–350 K and a Debye temperature of 574 K. The calculated zero-point
    renormalization of the electronic Kohn–Sham eigenvalues reveals a strong dependence
    on the phonon wave vectors, especially near Γ. Integrated over all phonon modes,
    our results indicate a vibrational correction of the electronic band gap of 0.41 eV
    at 0 K, which is in excellent agreement with the extrapolated temperature-dependent
    measurements.
article_number: '385402'
article_type: original
author:
- first_name: Michael
  full_name: Friedrich, Michael
  last_name: Friedrich
- first_name: Arthur
  full_name: Riefer, Arthur
  last_name: Riefer
- first_name: Simone
  full_name: Sanna, Simone
  last_name: Sanna
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: Arno
  full_name: Schindlmayr, Arno
  id: '458'
  last_name: Schindlmayr
  orcid: 0000-0002-4855-071X
citation:
  ama: 'Friedrich M, Riefer A, Sanna S, Schmidt WG, Schindlmayr A. Phonon dispersion
    and zero-point renormalization of LiNbO3 from density-functional perturbation
    theory. <i>Journal of Physics: Condensed Matter</i>. 2015;27(38). doi:<a href="https://doi.org/10.1088/0953-8984/27/38/385402">10.1088/0953-8984/27/38/385402</a>'
  apa: 'Friedrich, M., Riefer, A., Sanna, S., Schmidt, W. G., &#38; Schindlmayr, A.
    (2015). Phonon dispersion and zero-point renormalization of LiNbO3 from density-functional
    perturbation theory. <i>Journal of Physics: Condensed Matter</i>, <i>27</i>(38),
    Article 385402. <a href="https://doi.org/10.1088/0953-8984/27/38/385402">https://doi.org/10.1088/0953-8984/27/38/385402</a>'
  bibtex: '@article{Friedrich_Riefer_Sanna_Schmidt_Schindlmayr_2015, title={Phonon
    dispersion and zero-point renormalization of LiNbO3 from density-functional perturbation
    theory}, volume={27}, DOI={<a href="https://doi.org/10.1088/0953-8984/27/38/385402">10.1088/0953-8984/27/38/385402</a>},
    number={38385402}, journal={Journal of Physics: Condensed Matter}, publisher={IOP
    Publishing}, author={Friedrich, Michael and Riefer, Arthur and Sanna, Simone and
    Schmidt, Wolf Gero and Schindlmayr, Arno}, year={2015} }'
  chicago: 'Friedrich, Michael, Arthur Riefer, Simone Sanna, Wolf Gero Schmidt, and
    Arno Schindlmayr. “Phonon Dispersion and Zero-Point Renormalization of LiNbO3
    from Density-Functional Perturbation Theory.” <i>Journal of Physics: Condensed
    Matter</i> 27, no. 38 (2015). <a href="https://doi.org/10.1088/0953-8984/27/38/385402">https://doi.org/10.1088/0953-8984/27/38/385402</a>.'
  ieee: 'M. Friedrich, A. Riefer, S. Sanna, W. G. Schmidt, and A. Schindlmayr, “Phonon
    dispersion and zero-point renormalization of LiNbO3 from density-functional perturbation
    theory,” <i>Journal of Physics: Condensed Matter</i>, vol. 27, no. 38, Art. no.
    385402, 2015, doi: <a href="https://doi.org/10.1088/0953-8984/27/38/385402">10.1088/0953-8984/27/38/385402</a>.'
  mla: 'Friedrich, Michael, et al. “Phonon Dispersion and Zero-Point Renormalization
    of LiNbO3 from Density-Functional Perturbation Theory.” <i>Journal of Physics:
    Condensed Matter</i>, vol. 27, no. 38, 385402, IOP Publishing, 2015, doi:<a href="https://doi.org/10.1088/0953-8984/27/38/385402">10.1088/0953-8984/27/38/385402</a>.'
  short: 'M. Friedrich, A. Riefer, S. Sanna, W.G. Schmidt, A. Schindlmayr, Journal
    of Physics: Condensed Matter 27 (2015).'
date_created: 2019-05-29T08:41:18Z
date_updated: 2025-12-05T10:00:42Z
ddc:
- '530'
department:
- _id: '295'
- _id: '296'
- _id: '230'
- _id: '429'
- _id: '15'
- _id: '35'
- _id: '27'
doi: 10.1088/0953-8984/27/38/385402
external_id:
  isi:
  - '000362549700004'
  pmid:
  - '26337951'
file:
- access_level: closed
  content_type: application/pdf
  creator: schindlm
  date_created: 2020-08-28T14:24:23Z
  date_updated: 2020-08-30T14:46:56Z
  description: © 2015 IOP Publishing Ltd
  file_id: '18578'
  file_name: Friedrich_2015_J._Phys. _Condens._Matter_27_385402.pdf
  file_size: 1793430
  relation: main_file
  title: Phonon dispersion and zero-point renormalization of LiNbO3 from density-functional
    perturbation theory
file_date_updated: 2020-08-30T14:46:56Z
has_accepted_license: '1'
intvolume: '        27'
isi: '1'
issue: '38'
language:
- iso: eng
pmid: '1'
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
- _id: '53'
  name: TRR 142
- _id: '55'
  name: TRR 142 - Project Area B
- _id: '69'
  name: TRR 142 - Subproject B4
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: 'Journal of Physics: Condensed Matter'
publication_identifier:
  eissn:
  - 1361-648X
  issn:
  - 0953-8984
publication_status: published
publisher: IOP Publishing
quality_controlled: '1'
status: public
title: Phonon dispersion and zero-point renormalization of LiNbO3 from density-functional
  perturbation theory
type: journal_article
user_id: '16199'
volume: 27
year: '2015'
...
---
_id: '13493'
author:
- first_name: Stefan
  full_name: Müllegger, Stefan
  last_name: Müllegger
- first_name: Eva
  full_name: Rauls, Eva
  last_name: Rauls
- first_name: Uwe
  full_name: Gerstmann, Uwe
  id: '171'
  last_name: Gerstmann
  orcid: 0000-0002-4476-223X
- first_name: Stefano
  full_name: Tebi, Stefano
  last_name: Tebi
- first_name: Giulia
  full_name: Serrano, Giulia
  last_name: Serrano
- first_name: Stefan
  full_name: Wiespointner-Baumgarthuber, Stefan
  last_name: Wiespointner-Baumgarthuber
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: Reinhold
  full_name: Koch, Reinhold
  last_name: Koch
citation:
  ama: Müllegger S, Rauls E, Gerstmann U, et al. Mechanism for nuclear and electron
    spin excitation by radio frequency current. <i>Physical Review B</i>. 2015;92(22).
    doi:<a href="https://doi.org/10.1103/physrevb.92.220418">10.1103/physrevb.92.220418</a>
  apa: Müllegger, S., Rauls, E., Gerstmann, U., Tebi, S., Serrano, G., Wiespointner-Baumgarthuber,
    S., Schmidt, W. G., &#38; Koch, R. (2015). Mechanism for nuclear and electron
    spin excitation by radio frequency current. <i>Physical Review B</i>, <i>92</i>(22).
    <a href="https://doi.org/10.1103/physrevb.92.220418">https://doi.org/10.1103/physrevb.92.220418</a>
  bibtex: '@article{Müllegger_Rauls_Gerstmann_Tebi_Serrano_Wiespointner-Baumgarthuber_Schmidt_Koch_2015,
    title={Mechanism for nuclear and electron spin excitation by radio frequency current},
    volume={92}, DOI={<a href="https://doi.org/10.1103/physrevb.92.220418">10.1103/physrevb.92.220418</a>},
    number={22}, journal={Physical Review B}, author={Müllegger, Stefan and Rauls,
    Eva and Gerstmann, Uwe and Tebi, Stefano and Serrano, Giulia and Wiespointner-Baumgarthuber,
    Stefan and Schmidt, Wolf Gero and Koch, Reinhold}, year={2015} }'
  chicago: Müllegger, Stefan, Eva Rauls, Uwe Gerstmann, Stefano Tebi, Giulia Serrano,
    Stefan Wiespointner-Baumgarthuber, Wolf Gero Schmidt, and Reinhold Koch. “Mechanism
    for Nuclear and Electron Spin Excitation by Radio Frequency Current.” <i>Physical
    Review B</i> 92, no. 22 (2015). <a href="https://doi.org/10.1103/physrevb.92.220418">https://doi.org/10.1103/physrevb.92.220418</a>.
  ieee: 'S. Müllegger <i>et al.</i>, “Mechanism for nuclear and electron spin excitation
    by radio frequency current,” <i>Physical Review B</i>, vol. 92, no. 22, 2015,
    doi: <a href="https://doi.org/10.1103/physrevb.92.220418">10.1103/physrevb.92.220418</a>.'
  mla: Müllegger, Stefan, et al. “Mechanism for Nuclear and Electron Spin Excitation
    by Radio Frequency Current.” <i>Physical Review B</i>, vol. 92, no. 22, 2015,
    doi:<a href="https://doi.org/10.1103/physrevb.92.220418">10.1103/physrevb.92.220418</a>.
  short: S. Müllegger, E. Rauls, U. Gerstmann, S. Tebi, G. Serrano, S. Wiespointner-Baumgarthuber,
    W.G. Schmidt, R. Koch, Physical Review B 92 (2015).
date_created: 2019-09-30T12:31:01Z
date_updated: 2025-12-05T10:20:23Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '790'
- _id: '230'
- _id: '27'
doi: 10.1103/physrevb.92.220418
intvolume: '        92'
issue: '22'
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Physical Review B
publication_identifier:
  issn:
  - 1098-0121
  - 1550-235X
publication_status: published
status: public
title: Mechanism for nuclear and electron spin excitation by radio frequency current
type: journal_article
user_id: '16199'
volume: 92
year: '2015'
...
---
_id: '13496'
author:
- first_name: F.
  full_name: Edler, F.
  last_name: Edler
- first_name: I.
  full_name: Miccoli, I.
  last_name: Miccoli
- first_name: S.
  full_name: Demuth, S.
  last_name: Demuth
- first_name: H.
  full_name: Pfnür, H.
  last_name: Pfnür
- first_name: S.
  full_name: Wippermann, S.
  last_name: Wippermann
- first_name: A.
  full_name: Lücke, A.
  last_name: Lücke
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: C.
  full_name: Tegenkamp, C.
  last_name: Tegenkamp
citation:
  ama: Edler F, Miccoli I, Demuth S, et al. Interwire coupling forIn(4×1)/Si(111)
    probed by surface transport. <i>Physical Review B</i>. 2015;92(8). doi:<a href="https://doi.org/10.1103/physrevb.92.085426">10.1103/physrevb.92.085426</a>
  apa: Edler, F., Miccoli, I., Demuth, S., Pfnür, H., Wippermann, S., Lücke, A., Schmidt,
    W. G., &#38; Tegenkamp, C. (2015). Interwire coupling forIn(4×1)/Si(111) probed
    by surface transport. <i>Physical Review B</i>, <i>92</i>(8). <a href="https://doi.org/10.1103/physrevb.92.085426">https://doi.org/10.1103/physrevb.92.085426</a>
  bibtex: '@article{Edler_Miccoli_Demuth_Pfnür_Wippermann_Lücke_Schmidt_Tegenkamp_2015,
    title={Interwire coupling forIn(4×1)/Si(111) probed by surface transport}, volume={92},
    DOI={<a href="https://doi.org/10.1103/physrevb.92.085426">10.1103/physrevb.92.085426</a>},
    number={8}, journal={Physical Review B}, author={Edler, F. and Miccoli, I. and
    Demuth, S. and Pfnür, H. and Wippermann, S. and Lücke, A. and Schmidt, Wolf Gero
    and Tegenkamp, C.}, year={2015} }'
  chicago: Edler, F., I. Miccoli, S. Demuth, H. Pfnür, S. Wippermann, A. Lücke, Wolf
    Gero Schmidt, and C. Tegenkamp. “Interwire Coupling ForIn(4×1)/Si(111) Probed
    by Surface Transport.” <i>Physical Review B</i> 92, no. 8 (2015). <a href="https://doi.org/10.1103/physrevb.92.085426">https://doi.org/10.1103/physrevb.92.085426</a>.
  ieee: 'F. Edler <i>et al.</i>, “Interwire coupling forIn(4×1)/Si(111) probed by
    surface transport,” <i>Physical Review B</i>, vol. 92, no. 8, 2015, doi: <a href="https://doi.org/10.1103/physrevb.92.085426">10.1103/physrevb.92.085426</a>.'
  mla: Edler, F., et al. “Interwire Coupling ForIn(4×1)/Si(111) Probed by Surface
    Transport.” <i>Physical Review B</i>, vol. 92, no. 8, 2015, doi:<a href="https://doi.org/10.1103/physrevb.92.085426">10.1103/physrevb.92.085426</a>.
  short: F. Edler, I. Miccoli, S. Demuth, H. Pfnür, S. Wippermann, A. Lücke, W.G.
    Schmidt, C. Tegenkamp, Physical Review B 92 (2015).
date_created: 2019-09-30T12:44:24Z
date_updated: 2025-12-05T10:18:45Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '230'
- _id: '35'
- _id: '27'
doi: 10.1103/physrevb.92.085426
funded_apc: '1'
intvolume: '        92'
issue: '8'
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Physical Review B
publication_identifier:
  issn:
  - 1098-0121
  - 1550-235X
publication_status: published
status: public
title: Interwire coupling forIn(4×1)/Si(111) probed by surface transport
type: journal_article
user_id: '16199'
volume: 92
year: '2015'
...
---
_id: '13495'
author:
- first_name: Hazem
  full_name: Aldahhak, Hazem
  id: '26687'
  last_name: Aldahhak
- first_name: E.
  full_name: Rauls, E.
  last_name: Rauls
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: Aldahhak H, Rauls E, Schmidt WG. Diindenoperylene adsorption on Cu(111) studied
    with density-functional theory. <i>Surface Science</i>. Published online 2015:260-265.
    doi:<a href="https://doi.org/10.1016/j.susc.2015.03.007">10.1016/j.susc.2015.03.007</a>
  apa: Aldahhak, H., Rauls, E., &#38; Schmidt, W. G. (2015). Diindenoperylene adsorption
    on Cu(111) studied with density-functional theory. <i>Surface Science</i>, 260–265.
    <a href="https://doi.org/10.1016/j.susc.2015.03.007">https://doi.org/10.1016/j.susc.2015.03.007</a>
  bibtex: '@article{Aldahhak_Rauls_Schmidt_2015, title={Diindenoperylene adsorption
    on Cu(111) studied with density-functional theory}, DOI={<a href="https://doi.org/10.1016/j.susc.2015.03.007">10.1016/j.susc.2015.03.007</a>},
    journal={Surface Science}, author={Aldahhak, Hazem and Rauls, E. and Schmidt,
    Wolf Gero}, year={2015}, pages={260–265} }'
  chicago: Aldahhak, Hazem, E. Rauls, and Wolf Gero Schmidt. “Diindenoperylene Adsorption
    on Cu(111) Studied with Density-Functional Theory.” <i>Surface Science</i>, 2015,
    260–65. <a href="https://doi.org/10.1016/j.susc.2015.03.007">https://doi.org/10.1016/j.susc.2015.03.007</a>.
  ieee: 'H. Aldahhak, E. Rauls, and W. G. Schmidt, “Diindenoperylene adsorption on
    Cu(111) studied with density-functional theory,” <i>Surface Science</i>, pp. 260–265,
    2015, doi: <a href="https://doi.org/10.1016/j.susc.2015.03.007">10.1016/j.susc.2015.03.007</a>.'
  mla: Aldahhak, Hazem, et al. “Diindenoperylene Adsorption on Cu(111) Studied with
    Density-Functional Theory.” <i>Surface Science</i>, 2015, pp. 260–65, doi:<a href="https://doi.org/10.1016/j.susc.2015.03.007">10.1016/j.susc.2015.03.007</a>.
  short: H. Aldahhak, E. Rauls, W.G. Schmidt, Surface Science (2015) 260–265.
date_created: 2019-09-30T12:42:43Z
date_updated: 2025-12-05T10:19:11Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1016/j.susc.2015.03.007
language:
- iso: eng
page: 260-265
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Surface Science
publication_identifier:
  issn:
  - 0039-6028
publication_status: published
status: public
title: Diindenoperylene adsorption on Cu(111) studied with density-functional theory
type: journal_article
user_id: '16199'
year: '2015'
...
---
_id: '13494'
author:
- first_name: Hazem
  full_name: Aldahhak, Hazem
  last_name: Aldahhak
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: E.
  full_name: Rauls, E.
  last_name: Rauls
citation:
  ama: Aldahhak H, Schmidt WG, Rauls E. Single PTCDA molecules on planar and stepped
    KCl and NaCl(100) surfaces. <i>Surface Science</i>. Published online 2015:278-281.
    doi:<a href="https://doi.org/10.1016/j.susc.2015.01.013">10.1016/j.susc.2015.01.013</a>
  apa: Aldahhak, H., Schmidt, W. G., &#38; Rauls, E. (2015). Single PTCDA molecules
    on planar and stepped KCl and NaCl(100) surfaces. <i>Surface Science</i>, 278–281.
    <a href="https://doi.org/10.1016/j.susc.2015.01.013">https://doi.org/10.1016/j.susc.2015.01.013</a>
  bibtex: '@article{Aldahhak_Schmidt_Rauls_2015, title={Single PTCDA molecules on
    planar and stepped KCl and NaCl(100) surfaces}, DOI={<a href="https://doi.org/10.1016/j.susc.2015.01.013">10.1016/j.susc.2015.01.013</a>},
    journal={Surface Science}, author={Aldahhak, Hazem and Schmidt, Wolf Gero and
    Rauls, E.}, year={2015}, pages={278–281} }'
  chicago: Aldahhak, Hazem, Wolf Gero Schmidt, and E. Rauls. “Single PTCDA Molecules
    on Planar and Stepped KCl and NaCl(100) Surfaces.” <i>Surface Science</i>, 2015,
    278–81. <a href="https://doi.org/10.1016/j.susc.2015.01.013">https://doi.org/10.1016/j.susc.2015.01.013</a>.
  ieee: 'H. Aldahhak, W. G. Schmidt, and E. Rauls, “Single PTCDA molecules on planar
    and stepped KCl and NaCl(100) surfaces,” <i>Surface Science</i>, pp. 278–281,
    2015, doi: <a href="https://doi.org/10.1016/j.susc.2015.01.013">10.1016/j.susc.2015.01.013</a>.'
  mla: Aldahhak, Hazem, et al. “Single PTCDA Molecules on Planar and Stepped KCl and
    NaCl(100) Surfaces.” <i>Surface Science</i>, 2015, pp. 278–81, doi:<a href="https://doi.org/10.1016/j.susc.2015.01.013">10.1016/j.susc.2015.01.013</a>.
  short: H. Aldahhak, W.G. Schmidt, E. Rauls, Surface Science (2015) 278–281.
date_created: 2019-09-30T12:40:38Z
date_updated: 2025-12-05T10:19:47Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1016/j.susc.2015.01.013
language:
- iso: eng
page: 278-281
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Surface Science
publication_identifier:
  issn:
  - 0039-6028
publication_status: published
status: public
title: Single PTCDA molecules on planar and stepped KCl and NaCl(100) surfaces
type: journal_article
user_id: '16199'
year: '2015'
...
---
_id: '13502'
author:
- first_name: C.
  full_name: Klein, C.
  last_name: Klein
- first_name: N. J.
  full_name: Vollmers, N. J.
  last_name: Vollmers
- first_name: Uwe
  full_name: Gerstmann, Uwe
  id: '171'
  last_name: Gerstmann
  orcid: 0000-0002-4476-223X
- first_name: P.
  full_name: Zahl, P.
  last_name: Zahl
- first_name: D.
  full_name: Lükermann, D.
  last_name: Lükermann
- first_name: G.
  full_name: Jnawali, G.
  last_name: Jnawali
- first_name: H.
  full_name: Pfnür, H.
  last_name: Pfnür
- first_name: C.
  full_name: Tegenkamp, C.
  last_name: Tegenkamp
- first_name: P.
  full_name: Sutter, P.
  last_name: Sutter
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: M.
  full_name: Horn-von Hoegen, M.
  last_name: Horn-von Hoegen
citation:
  ama: Klein C, Vollmers NJ, Gerstmann U, et al. Barrier-free subsurface incorporation
    of 3d metal atoms into Bi(111) films. <i>Physical Review B</i>. 2015;91(19). doi:<a
    href="https://doi.org/10.1103/physrevb.91.195441">10.1103/physrevb.91.195441</a>
  apa: Klein, C., Vollmers, N. J., Gerstmann, U., Zahl, P., Lükermann, D., Jnawali,
    G., Pfnür, H., Tegenkamp, C., Sutter, P., Schmidt, W. G., &#38; Horn-von Hoegen,
    M. (2015). Barrier-free subsurface incorporation of 3d metal atoms into Bi(111)
    films. <i>Physical Review B</i>, <i>91</i>(19). <a href="https://doi.org/10.1103/physrevb.91.195441">https://doi.org/10.1103/physrevb.91.195441</a>
  bibtex: '@article{Klein_Vollmers_Gerstmann_Zahl_Lükermann_Jnawali_Pfnür_Tegenkamp_Sutter_Schmidt_et
    al._2015, title={Barrier-free subsurface incorporation of 3d metal atoms into
    Bi(111) films}, volume={91}, DOI={<a href="https://doi.org/10.1103/physrevb.91.195441">10.1103/physrevb.91.195441</a>},
    number={19}, journal={Physical Review B}, author={Klein, C. and Vollmers, N. J.
    and Gerstmann, Uwe and Zahl, P. and Lükermann, D. and Jnawali, G. and Pfnür, H.
    and Tegenkamp, C. and Sutter, P. and Schmidt, Wolf Gero and et al.}, year={2015}
    }'
  chicago: Klein, C., N. J. Vollmers, Uwe Gerstmann, P. Zahl, D. Lükermann, G. Jnawali,
    H. Pfnür, et al. “Barrier-Free Subsurface Incorporation of 3d Metal Atoms into
    Bi(111) Films.” <i>Physical Review B</i> 91, no. 19 (2015). <a href="https://doi.org/10.1103/physrevb.91.195441">https://doi.org/10.1103/physrevb.91.195441</a>.
  ieee: 'C. Klein <i>et al.</i>, “Barrier-free subsurface incorporation of 3d metal
    atoms into Bi(111) films,” <i>Physical Review B</i>, vol. 91, no. 19, 2015, doi:
    <a href="https://doi.org/10.1103/physrevb.91.195441">10.1103/physrevb.91.195441</a>.'
  mla: Klein, C., et al. “Barrier-Free Subsurface Incorporation of 3d Metal Atoms
    into Bi(111) Films.” <i>Physical Review B</i>, vol. 91, no. 19, 2015, doi:<a href="https://doi.org/10.1103/physrevb.91.195441">10.1103/physrevb.91.195441</a>.
  short: C. Klein, N.J. Vollmers, U. Gerstmann, P. Zahl, D. Lükermann, G. Jnawali,
    H. Pfnür, C. Tegenkamp, P. Sutter, W.G. Schmidt, M. Horn-von Hoegen, Physical
    Review B 91 (2015).
date_created: 2019-09-30T13:01:01Z
date_updated: 2025-12-05T10:38:18Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '790'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1103/physrevb.91.195441
funded_apc: '1'
intvolume: '        91'
issue: '19'
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Physical Review B
publication_identifier:
  issn:
  - 1098-0121
  - 1550-235X
publication_status: published
status: public
title: Barrier-free subsurface incorporation of 3d metal atoms into Bi(111) films
type: journal_article
user_id: '16199'
volume: 91
year: '2015'
...
---
_id: '13504'
author:
- first_name: S.
  full_name: Sanna, S.
  last_name: Sanna
- first_name: C.
  full_name: Dues, C.
  last_name: Dues
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: Sanna S, Dues C, Schmidt WG. Modeling atomic force microscopy at LiNbO 3 surfaces
    from first-principles. <i>Computational Materials Science</i>. 2015;103:145-150.
    doi:<a href="https://doi.org/10.1016/j.commatsci.2015.03.025">10.1016/j.commatsci.2015.03.025</a>
  apa: Sanna, S., Dues, C., &#38; Schmidt, W. G. (2015). Modeling atomic force microscopy
    at LiNbO 3 surfaces from first-principles. <i>Computational Materials Science</i>,
    <i>103</i>, 145–150. <a href="https://doi.org/10.1016/j.commatsci.2015.03.025">https://doi.org/10.1016/j.commatsci.2015.03.025</a>
  bibtex: '@article{Sanna_Dues_Schmidt_2015, title={Modeling atomic force microscopy
    at LiNbO 3 surfaces from first-principles}, volume={103}, DOI={<a href="https://doi.org/10.1016/j.commatsci.2015.03.025">10.1016/j.commatsci.2015.03.025</a>},
    journal={Computational Materials Science}, author={Sanna, S. and Dues, C. and
    Schmidt, Wolf Gero}, year={2015}, pages={145–150} }'
  chicago: 'Sanna, S., C. Dues, and Wolf Gero Schmidt. “Modeling Atomic Force Microscopy
    at LiNbO 3 Surfaces from First-Principles.” <i>Computational Materials Science</i>
    103 (2015): 145–50. <a href="https://doi.org/10.1016/j.commatsci.2015.03.025">https://doi.org/10.1016/j.commatsci.2015.03.025</a>.'
  ieee: 'S. Sanna, C. Dues, and W. G. Schmidt, “Modeling atomic force microscopy at
    LiNbO 3 surfaces from first-principles,” <i>Computational Materials Science</i>,
    vol. 103, pp. 145–150, 2015, doi: <a href="https://doi.org/10.1016/j.commatsci.2015.03.025">10.1016/j.commatsci.2015.03.025</a>.'
  mla: Sanna, S., et al. “Modeling Atomic Force Microscopy at LiNbO 3 Surfaces from
    First-Principles.” <i>Computational Materials Science</i>, vol. 103, 2015, pp.
    145–50, doi:<a href="https://doi.org/10.1016/j.commatsci.2015.03.025">10.1016/j.commatsci.2015.03.025</a>.
  short: S. Sanna, C. Dues, W.G. Schmidt, Computational Materials Science 103 (2015)
    145–150.
date_created: 2019-09-30T13:06:04Z
date_updated: 2025-12-05T10:37:16Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '429'
- _id: '27'
doi: 10.1016/j.commatsci.2015.03.025
intvolume: '       103'
language:
- iso: eng
page: 145-150
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
- _id: '53'
  name: TRR 142
- _id: '55'
  name: TRR 142 - Project Area B
- _id: '68'
  name: TRR 142 - Subproject B3
- _id: '69'
  name: TRR 142 - Subproject B4
- _id: '53'
  name: 'TRR 142: Maßgeschneiderte nichtlineare Photonik: Von grundlegenden Konzepten
    zu funktionellen Strukturen'
publication: Computational Materials Science
publication_identifier:
  issn:
  - 0927-0256
publication_status: published
status: public
title: Modeling atomic force microscopy at LiNbO 3 surfaces from first-principles
type: journal_article
user_id: '16199'
volume: 103
year: '2015'
...
---
_id: '13500'
author:
- first_name: A.
  full_name: Lücke, A.
  last_name: Lücke
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: E.
  full_name: Rauls, E.
  last_name: Rauls
- first_name: F.
  full_name: Ortmann, F.
  last_name: Ortmann
- first_name: Uwe
  full_name: Gerstmann, Uwe
  id: '171'
  last_name: Gerstmann
  orcid: 0000-0002-4476-223X
citation:
  ama: Lücke A, Schmidt WG, Rauls E, Ortmann F, Gerstmann U. Influence of Structural
    Defects and Oxidation onto Hole Conductivity in P3HT. <i>The Journal of Physical
    Chemistry B</i>. 2015;119:6481-6491. doi:<a href="https://doi.org/10.1021/acs.jpcb.5b03615">10.1021/acs.jpcb.5b03615</a>
  apa: Lücke, A., Schmidt, W. G., Rauls, E., Ortmann, F., &#38; Gerstmann, U. (2015).
    Influence of Structural Defects and Oxidation onto Hole Conductivity in P3HT.
    <i>The Journal of Physical Chemistry B</i>, <i>119</i>, 6481–6491. <a href="https://doi.org/10.1021/acs.jpcb.5b03615">https://doi.org/10.1021/acs.jpcb.5b03615</a>
  bibtex: '@article{Lücke_Schmidt_Rauls_Ortmann_Gerstmann_2015, title={Influence of
    Structural Defects and Oxidation onto Hole Conductivity in P3HT}, volume={119},
    DOI={<a href="https://doi.org/10.1021/acs.jpcb.5b03615">10.1021/acs.jpcb.5b03615</a>},
    journal={The Journal of Physical Chemistry B}, author={Lücke, A. and Schmidt,
    Wolf Gero and Rauls, E. and Ortmann, F. and Gerstmann, Uwe}, year={2015}, pages={6481–6491}
    }'
  chicago: 'Lücke, A., Wolf Gero Schmidt, E. Rauls, F. Ortmann, and Uwe Gerstmann.
    “Influence of Structural Defects and Oxidation onto Hole Conductivity in P3HT.”
    <i>The Journal of Physical Chemistry B</i> 119 (2015): 6481–91. <a href="https://doi.org/10.1021/acs.jpcb.5b03615">https://doi.org/10.1021/acs.jpcb.5b03615</a>.'
  ieee: 'A. Lücke, W. G. Schmidt, E. Rauls, F. Ortmann, and U. Gerstmann, “Influence
    of Structural Defects and Oxidation onto Hole Conductivity in P3HT,” <i>The Journal
    of Physical Chemistry B</i>, vol. 119, pp. 6481–6491, 2015, doi: <a href="https://doi.org/10.1021/acs.jpcb.5b03615">10.1021/acs.jpcb.5b03615</a>.'
  mla: Lücke, A., et al. “Influence of Structural Defects and Oxidation onto Hole
    Conductivity in P3HT.” <i>The Journal of Physical Chemistry B</i>, vol. 119, 2015,
    pp. 6481–91, doi:<a href="https://doi.org/10.1021/acs.jpcb.5b03615">10.1021/acs.jpcb.5b03615</a>.
  short: A. Lücke, W.G. Schmidt, E. Rauls, F. Ortmann, U. Gerstmann, The Journal of
    Physical Chemistry B 119 (2015) 6481–6491.
date_created: 2019-09-30T12:55:43Z
date_updated: 2025-12-05T10:38:44Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '790'
- _id: '230'
- _id: '27'
doi: 10.1021/acs.jpcb.5b03615
intvolume: '       119'
language:
- iso: eng
page: 6481-6491
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: The Journal of Physical Chemistry B
publication_identifier:
  issn:
  - 1520-6106
  - 1520-5207
publication_status: published
status: public
title: Influence of Structural Defects and Oxidation onto Hole Conductivity in P3HT
type: journal_article
user_id: '16199'
volume: 119
year: '2015'
...
---
_id: '13507'
author:
- first_name: M.
  full_name: Landmann, M.
  last_name: Landmann
- first_name: E.
  full_name: Rauls, E.
  last_name: Rauls
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: M. D.
  full_name: Neumann, M. D.
  last_name: Neumann
- first_name: E.
  full_name: Speiser, E.
  last_name: Speiser
- first_name: N.
  full_name: Esser, N.
  last_name: Esser
citation:
  ama: 'Landmann M, Rauls E, Schmidt WG, Neumann MD, Speiser E, Esser N. GaNm-plane:
    Atomic structure, surface bands, and optical response. <i>Physical Review B</i>.
    2015;91. doi:<a href="https://doi.org/10.1103/physrevb.91.035302">10.1103/physrevb.91.035302</a>'
  apa: 'Landmann, M., Rauls, E., Schmidt, W. G., Neumann, M. D., Speiser, E., &#38;
    Esser, N. (2015). GaNm-plane: Atomic structure, surface bands, and optical response.
    <i>Physical Review B</i>, <i>91</i>. <a href="https://doi.org/10.1103/physrevb.91.035302">https://doi.org/10.1103/physrevb.91.035302</a>'
  bibtex: '@article{Landmann_Rauls_Schmidt_Neumann_Speiser_Esser_2015, title={GaNm-plane:
    Atomic structure, surface bands, and optical response}, volume={91}, DOI={<a href="https://doi.org/10.1103/physrevb.91.035302">10.1103/physrevb.91.035302</a>},
    journal={Physical Review B}, author={Landmann, M. and Rauls, E. and Schmidt, Wolf
    Gero and Neumann, M. D. and Speiser, E. and Esser, N.}, year={2015} }'
  chicago: 'Landmann, M., E. Rauls, Wolf Gero Schmidt, M. D. Neumann, E. Speiser,
    and N. Esser. “GaNm-Plane: Atomic Structure, Surface Bands, and Optical Response.”
    <i>Physical Review B</i> 91 (2015). <a href="https://doi.org/10.1103/physrevb.91.035302">https://doi.org/10.1103/physrevb.91.035302</a>.'
  ieee: 'M. Landmann, E. Rauls, W. G. Schmidt, M. D. Neumann, E. Speiser, and N. Esser,
    “GaNm-plane: Atomic structure, surface bands, and optical response,” <i>Physical
    Review B</i>, vol. 91, 2015, doi: <a href="https://doi.org/10.1103/physrevb.91.035302">10.1103/physrevb.91.035302</a>.'
  mla: 'Landmann, M., et al. “GaNm-Plane: Atomic Structure, Surface Bands, and Optical
    Response.” <i>Physical Review B</i>, vol. 91, 2015, doi:<a href="https://doi.org/10.1103/physrevb.91.035302">10.1103/physrevb.91.035302</a>.'
  short: M. Landmann, E. Rauls, W.G. Schmidt, M.D. Neumann, E. Speiser, N. Esser,
    Physical Review B 91 (2015).
date_created: 2019-09-30T13:24:00Z
date_updated: 2025-12-05T10:35:47Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '429'
- _id: '27'
doi: 10.1103/physrevb.91.035302
intvolume: '        91'
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
- _id: '53'
  name: TRR 142
- _id: '55'
  name: TRR 142 - Project Area B
- _id: '66'
  name: TRR 142 - Subproject B1
- _id: '69'
  name: TRR 142 - Subproject B4
publication: Physical Review B
publication_identifier:
  issn:
  - 1098-0121
  - 1550-235X
publication_status: published
status: public
title: 'GaNm-plane: Atomic structure, surface bands, and optical response'
type: journal_article
user_id: '16199'
volume: 91
year: '2015'
...
---
_id: '13498'
author:
- first_name: Martin
  full_name: Rohrmüller, Martin
  last_name: Rohrmüller
- first_name: Alexander
  full_name: Hoffmann, Alexander
  last_name: Hoffmann
- first_name: Christian
  full_name: Thierfelder, Christian
  last_name: Thierfelder
- first_name: Sonja
  full_name: Herres-Pawlis, Sonja
  last_name: Herres-Pawlis
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: 'Rohrmüller M, Hoffmann A, Thierfelder C, Herres-Pawlis S, Schmidt WG. The
    Cu2O2torture track for a real-life system: [Cu2(btmgp)2O2]2+oxo and peroxo species
    in density functional calculations†. <i>Journal of Computational Chemistry</i>.
    2015;36(21-22):1672-1685. doi:<a href="https://doi.org/10.1002/jcc.23983">10.1002/jcc.23983</a>'
  apa: 'Rohrmüller, M., Hoffmann, A., Thierfelder, C., Herres-Pawlis, S., &#38; Schmidt,
    W. G. (2015). The Cu2O2torture track for a real-life system: [Cu2(btmgp)2O2]2+oxo
    and peroxo species in density functional calculations†. <i>Journal of Computational
    Chemistry</i>, <i>36</i>(21–22), 1672–1685. <a href="https://doi.org/10.1002/jcc.23983">https://doi.org/10.1002/jcc.23983</a>'
  bibtex: '@article{Rohrmüller_Hoffmann_Thierfelder_Herres-Pawlis_Schmidt_2015, title={The
    Cu2O2torture track for a real-life system: [Cu2(btmgp)2O2]2+oxo and peroxo species
    in density functional calculations†}, volume={36}, DOI={<a href="https://doi.org/10.1002/jcc.23983">10.1002/jcc.23983</a>},
    number={21–22}, journal={Journal of Computational Chemistry}, author={Rohrmüller,
    Martin and Hoffmann, Alexander and Thierfelder, Christian and Herres-Pawlis, Sonja
    and Schmidt, Wolf Gero}, year={2015}, pages={1672–1685} }'
  chicago: 'Rohrmüller, Martin, Alexander Hoffmann, Christian Thierfelder, Sonja Herres-Pawlis,
    and Wolf Gero Schmidt. “The Cu2O2torture Track for a Real-Life System: [Cu2(Btmgp)2O2]2+oxo
    and Peroxo Species in Density Functional Calculations†.” <i>Journal of Computational
    Chemistry</i> 36, no. 21–22 (2015): 1672–85. <a href="https://doi.org/10.1002/jcc.23983">https://doi.org/10.1002/jcc.23983</a>.'
  ieee: 'M. Rohrmüller, A. Hoffmann, C. Thierfelder, S. Herres-Pawlis, and W. G. Schmidt,
    “The Cu2O2torture track for a real-life system: [Cu2(btmgp)2O2]2+oxo and peroxo
    species in density functional calculations†,” <i>Journal of Computational Chemistry</i>,
    vol. 36, no. 21–22, pp. 1672–1685, 2015, doi: <a href="https://doi.org/10.1002/jcc.23983">10.1002/jcc.23983</a>.'
  mla: 'Rohrmüller, Martin, et al. “The Cu2O2torture Track for a Real-Life System:
    [Cu2(Btmgp)2O2]2+oxo and Peroxo Species in Density Functional Calculations†.”
    <i>Journal of Computational Chemistry</i>, vol. 36, no. 21–22, 2015, pp. 1672–85,
    doi:<a href="https://doi.org/10.1002/jcc.23983">10.1002/jcc.23983</a>.'
  short: M. Rohrmüller, A. Hoffmann, C. Thierfelder, S. Herres-Pawlis, W.G. Schmidt,
    Journal of Computational Chemistry 36 (2015) 1672–1685.
date_created: 2019-09-30T12:48:40Z
date_updated: 2025-12-05T10:39:31Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1002/jcc.23983
funded_apc: '1'
intvolume: '        36'
issue: 21-22
language:
- iso: eng
page: 1672-1685
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Journal of Computational Chemistry
publication_identifier:
  issn:
  - 0192-8651
publication_status: published
status: public
title: 'The Cu2O2torture track for a real-life system: [Cu2(btmgp)2O2]2+oxo and peroxo
  species in density functional calculations†'
type: journal_article
user_id: '16199'
volume: 36
year: '2015'
...
---
_id: '13497'
author:
- first_name: Amirreza
  full_name: Baghbanpourasl, Amirreza
  last_name: Baghbanpourasl
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: Mariella
  full_name: Denk, Mariella
  last_name: Denk
- first_name: Christoph
  full_name: Cobet, Christoph
  last_name: Cobet
- first_name: Michael
  full_name: Hohage, Michael
  last_name: Hohage
- first_name: Peter
  full_name: Zeppenfeld, Peter
  last_name: Zeppenfeld
- first_name: Kurt
  full_name: Hingerl, Kurt
  last_name: Hingerl
citation:
  ama: Baghbanpourasl A, Schmidt WG, Denk M, et al. Water adsorbate influence on the
    Cu(110) surface optical response. <i>Surface Science</i>. 2015;641:231-236. doi:<a
    href="https://doi.org/10.1016/j.susc.2015.07.020">10.1016/j.susc.2015.07.020</a>
  apa: Baghbanpourasl, A., Schmidt, W. G., Denk, M., Cobet, C., Hohage, M., Zeppenfeld,
    P., &#38; Hingerl, K. (2015). Water adsorbate influence on the Cu(110) surface
    optical response. <i>Surface Science</i>, <i>641</i>, 231–236. <a href="https://doi.org/10.1016/j.susc.2015.07.020">https://doi.org/10.1016/j.susc.2015.07.020</a>
  bibtex: '@article{Baghbanpourasl_Schmidt_Denk_Cobet_Hohage_Zeppenfeld_Hingerl_2015,
    title={Water adsorbate influence on the Cu(110) surface optical response}, volume={641},
    DOI={<a href="https://doi.org/10.1016/j.susc.2015.07.020">10.1016/j.susc.2015.07.020</a>},
    journal={Surface Science}, author={Baghbanpourasl, Amirreza and Schmidt, Wolf
    Gero and Denk, Mariella and Cobet, Christoph and Hohage, Michael and Zeppenfeld,
    Peter and Hingerl, Kurt}, year={2015}, pages={231–236} }'
  chicago: 'Baghbanpourasl, Amirreza, Wolf Gero Schmidt, Mariella Denk, Christoph
    Cobet, Michael Hohage, Peter Zeppenfeld, and Kurt Hingerl. “Water Adsorbate Influence
    on the Cu(110) Surface Optical Response.” <i>Surface Science</i> 641 (2015): 231–36.
    <a href="https://doi.org/10.1016/j.susc.2015.07.020">https://doi.org/10.1016/j.susc.2015.07.020</a>.'
  ieee: 'A. Baghbanpourasl <i>et al.</i>, “Water adsorbate influence on the Cu(110)
    surface optical response,” <i>Surface Science</i>, vol. 641, pp. 231–236, 2015,
    doi: <a href="https://doi.org/10.1016/j.susc.2015.07.020">10.1016/j.susc.2015.07.020</a>.'
  mla: Baghbanpourasl, Amirreza, et al. “Water Adsorbate Influence on the Cu(110)
    Surface Optical Response.” <i>Surface Science</i>, vol. 641, 2015, pp. 231–36,
    doi:<a href="https://doi.org/10.1016/j.susc.2015.07.020">10.1016/j.susc.2015.07.020</a>.
  short: A. Baghbanpourasl, W.G. Schmidt, M. Denk, C. Cobet, M. Hohage, P. Zeppenfeld,
    K. Hingerl, Surface Science 641 (2015) 231–236.
date_created: 2019-09-30T12:45:59Z
date_updated: 2025-12-05T10:39:53Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1016/j.susc.2015.07.020
intvolume: '       641'
language:
- iso: eng
page: 231-236
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Surface Science
publication_identifier:
  issn:
  - 0039-6028
publication_status: published
status: public
title: Water adsorbate influence on the Cu(110) surface optical response
type: journal_article
user_id: '16199'
volume: 641
year: '2015'
...
---
_id: '22946'
abstract:
- lang: eng
  text: The Kane–Mele model was previously used to describe effective spin–orbit couplings
    (SOCs) in graphene. Here we extend this model and also incorporate curvature effects
    to analyze the combined influence of SOC and curvature on the band structure of
    carbon nanotubes (CNTs). The extended model then reproduces the chirality-dependent
    asymmetric electron-hole splitting for semiconducting CNTs and in the band structure
    for metallic CNTs shows an opening of the band gap and a change of the Fermi wave
    vector with spin. For chiral semiconducting CNTs with large chiral angle we show
    that the spin-splitting configuration of bands near the Fermi energy depends on
    the value of $\text{mod}(2n+m,3)$ .
article_number: '445501'
author:
- first_name: Hong
  full_name: Liu, Hong
  last_name: Liu
- first_name: Dirk Florian
  full_name: Heinze, Dirk Florian
  id: '10904'
  last_name: Heinze
- first_name: Huynh
  full_name: Thanh Duc, Huynh
  last_name: Thanh Duc
- first_name: Stefan
  full_name: Schumacher, Stefan
  id: '27271'
  last_name: Schumacher
  orcid: 0000-0003-4042-4951
- first_name: Torsten
  full_name: Meier, Torsten
  id: '344'
  last_name: Meier
  orcid: 0000-0001-8864-2072
citation:
  ama: 'Liu H, Heinze DF, Thanh Duc H, Schumacher S, Meier T. Curvature effects in
    the band structure of carbon nanotubes including spin–orbit coupling. <i>Journal
    of Physics: Condensed Matter</i>. 2015;27(44). doi:<a href="https://doi.org/10.1088/0953-8984/27/44/445501">10.1088/0953-8984/27/44/445501</a>'
  apa: 'Liu, H., Heinze, D. F., Thanh Duc, H., Schumacher, S., &#38; Meier, T. (2015).
    Curvature effects in the band structure of carbon nanotubes including spin–orbit
    coupling. <i>Journal of Physics: Condensed Matter</i>, <i>27</i>(44), Article
    445501. <a href="https://doi.org/10.1088/0953-8984/27/44/445501">https://doi.org/10.1088/0953-8984/27/44/445501</a>'
  bibtex: '@article{Liu_Heinze_Thanh Duc_Schumacher_Meier_2015, title={Curvature effects
    in the band structure of carbon nanotubes including spin–orbit coupling}, volume={27},
    DOI={<a href="https://doi.org/10.1088/0953-8984/27/44/445501">10.1088/0953-8984/27/44/445501</a>},
    number={44445501}, journal={Journal of Physics: Condensed Matter}, author={Liu,
    Hong and Heinze, Dirk Florian and Thanh Duc, Huynh and Schumacher, Stefan and
    Meier, Torsten}, year={2015} }'
  chicago: 'Liu, Hong, Dirk Florian Heinze, Huynh Thanh Duc, Stefan Schumacher, and
    Torsten Meier. “Curvature Effects in the Band Structure of Carbon Nanotubes Including
    Spin–Orbit Coupling.” <i>Journal of Physics: Condensed Matter</i> 27, no. 44 (2015).
    <a href="https://doi.org/10.1088/0953-8984/27/44/445501">https://doi.org/10.1088/0953-8984/27/44/445501</a>.'
  ieee: 'H. Liu, D. F. Heinze, H. Thanh Duc, S. Schumacher, and T. Meier, “Curvature
    effects in the band structure of carbon nanotubes including spin–orbit coupling,”
    <i>Journal of Physics: Condensed Matter</i>, vol. 27, no. 44, Art. no. 445501,
    2015, doi: <a href="https://doi.org/10.1088/0953-8984/27/44/445501">10.1088/0953-8984/27/44/445501</a>.'
  mla: 'Liu, Hong, et al. “Curvature Effects in the Band Structure of Carbon Nanotubes
    Including Spin–Orbit Coupling.” <i>Journal of Physics: Condensed Matter</i>, vol.
    27, no. 44, 445501, 2015, doi:<a href="https://doi.org/10.1088/0953-8984/27/44/445501">10.1088/0953-8984/27/44/445501</a>.'
  short: 'H. Liu, D.F. Heinze, H. Thanh Duc, S. Schumacher, T. Meier, Journal of Physics:
    Condensed Matter 27 (2015).'
date_created: 2021-08-06T08:49:10Z
date_updated: 2025-12-05T14:48:46Z
department:
- _id: '15'
- _id: '170'
- _id: '293'
- _id: '297'
- _id: '230'
- _id: '35'
- _id: '27'
doi: 10.1088/0953-8984/27/44/445501
intvolume: '        27'
issue: '44'
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
- _id: '52'
  name: 'PC2: Computing Resources Provided by the Paderborn Center for Parallel Computing'
publication: 'Journal of Physics: Condensed Matter'
publication_identifier:
  issn:
  - 0953-8984
  - 1361-648X
publication_status: published
status: public
title: Curvature effects in the band structure of carbon nanotubes including spin–orbit
  coupling
type: journal_article
user_id: '16199'
volume: 27
year: '2015'
...
---
_id: '13922'
article_number: '445501'
author:
- first_name: Hong
  full_name: Liu, Hong
  last_name: Liu
- first_name: Dirk Florian
  full_name: Heinze, Dirk Florian
  id: '10904'
  last_name: Heinze
- first_name: Huynh
  full_name: Thanh Duc, Huynh
  last_name: Thanh Duc
- first_name: Stefan
  full_name: Schumacher, Stefan
  id: '27271'
  last_name: Schumacher
  orcid: 0000-0003-4042-4951
- first_name: Torsten
  full_name: Meier, Torsten
  id: '344'
  last_name: Meier
  orcid: 0000-0001-8864-2072
citation:
  ama: 'Liu H, Heinze DF, Thanh Duc H, Schumacher S, Meier T. Curvature effects in
    the band structure of carbon nanotubes including spin–orbit coupling. <i>Journal
    of Physics: Condensed Matter</i>. 2015;27(44). doi:<a href="https://doi.org/10.1088/0953-8984/27/44/445501">10.1088/0953-8984/27/44/445501</a>'
  apa: 'Liu, H., Heinze, D. F., Thanh Duc, H., Schumacher, S., &#38; Meier, T. (2015).
    Curvature effects in the band structure of carbon nanotubes including spin–orbit
    coupling. <i>Journal of Physics: Condensed Matter</i>, <i>27</i>(44), Article
    445501. <a href="https://doi.org/10.1088/0953-8984/27/44/445501">https://doi.org/10.1088/0953-8984/27/44/445501</a>'
  bibtex: '@article{Liu_Heinze_Thanh Duc_Schumacher_Meier_2015, title={Curvature effects
    in the band structure of carbon nanotubes including spin–orbit coupling}, volume={27},
    DOI={<a href="https://doi.org/10.1088/0953-8984/27/44/445501">10.1088/0953-8984/27/44/445501</a>},
    number={44445501}, journal={Journal of Physics: Condensed Matter}, author={Liu,
    Hong and Heinze, Dirk Florian and Thanh Duc, Huynh and Schumacher, Stefan and
    Meier, Torsten}, year={2015} }'
  chicago: 'Liu, Hong, Dirk Florian Heinze, Huynh Thanh Duc, Stefan Schumacher, and
    Torsten Meier. “Curvature Effects in the Band Structure of Carbon Nanotubes Including
    Spin–Orbit Coupling.” <i>Journal of Physics: Condensed Matter</i> 27, no. 44 (2015).
    <a href="https://doi.org/10.1088/0953-8984/27/44/445501">https://doi.org/10.1088/0953-8984/27/44/445501</a>.'
  ieee: 'H. Liu, D. F. Heinze, H. Thanh Duc, S. Schumacher, and T. Meier, “Curvature
    effects in the band structure of carbon nanotubes including spin–orbit coupling,”
    <i>Journal of Physics: Condensed Matter</i>, vol. 27, no. 44, Art. no. 445501,
    2015, doi: <a href="https://doi.org/10.1088/0953-8984/27/44/445501">10.1088/0953-8984/27/44/445501</a>.'
  mla: 'Liu, Hong, et al. “Curvature Effects in the Band Structure of Carbon Nanotubes
    Including Spin–Orbit Coupling.” <i>Journal of Physics: Condensed Matter</i>, vol.
    27, no. 44, 445501, 2015, doi:<a href="https://doi.org/10.1088/0953-8984/27/44/445501">10.1088/0953-8984/27/44/445501</a>.'
  short: 'H. Liu, D.F. Heinze, H. Thanh Duc, S. Schumacher, T. Meier, Journal of Physics:
    Condensed Matter 27 (2015).'
date_created: 2019-10-18T08:55:01Z
date_updated: 2025-12-05T14:48:14Z
department:
- _id: '15'
- _id: '170'
- _id: '293'
- _id: '297'
- _id: '230'
- _id: '35'
- _id: '27'
doi: 10.1088/0953-8984/27/44/445501
funded_apc: '1'
intvolume: '        27'
issue: '44'
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
- _id: '52'
  name: 'PC2: Computing Resources Provided by the Paderborn Center for Parallel Computing'
publication: 'Journal of Physics: Condensed Matter'
publication_identifier:
  issn:
  - 0953-8984
  - 1361-648X
publication_status: published
status: public
title: Curvature effects in the band structure of carbon nanotubes including spin–orbit
  coupling
type: journal_article
user_id: '16199'
volume: 27
year: '2015'
...
---
_id: '15860'
author:
- first_name: Jean-Christophe
  full_name: Denis, Jean-Christophe
  last_name: Denis
- first_name: Stefan
  full_name: Schumacher, Stefan
  id: '27271'
  last_name: Schumacher
  orcid: 0000-0003-4042-4951
- first_name: Gordon J.
  full_name: Hedley, Gordon J.
  last_name: Hedley
- first_name: Arvydas
  full_name: Ruseckas, Arvydas
  last_name: Ruseckas
- first_name: Paulina O.
  full_name: Morawska, Paulina O.
  last_name: Morawska
- first_name: Yue
  full_name: Wang, Yue
  last_name: Wang
- first_name: Sybille
  full_name: Allard, Sybille
  last_name: Allard
- first_name: Ullrich
  full_name: Scherf, Ullrich
  last_name: Scherf
- first_name: Graham A.
  full_name: Turnbull, Graham A.
  last_name: Turnbull
- first_name: Ifor D. W.
  full_name: Samuel, Ifor D. W.
  last_name: Samuel
- first_name: Ian
  full_name: Galbraith, Ian
  last_name: Galbraith
citation:
  ama: Denis J-C, Schumacher S, Hedley GJ, et al. Subpicosecond Exciton Dynamics in
    Polyfluorene Films from Experiment and Microscopic Theory. <i>The Journal of Physical
    Chemistry C</i>. Published online 2015:9734-9744. doi:<a href="https://doi.org/10.1021/acs.jpcc.5b00680">10.1021/acs.jpcc.5b00680</a>
  apa: Denis, J.-C., Schumacher, S., Hedley, G. J., Ruseckas, A., Morawska, P. O.,
    Wang, Y., Allard, S., Scherf, U., Turnbull, G. A., Samuel, I. D. W., &#38; Galbraith,
    I. (2015). Subpicosecond Exciton Dynamics in Polyfluorene Films from Experiment
    and Microscopic Theory. <i>The Journal of Physical Chemistry C</i>, 9734–9744.
    <a href="https://doi.org/10.1021/acs.jpcc.5b00680">https://doi.org/10.1021/acs.jpcc.5b00680</a>
  bibtex: '@article{Denis_Schumacher_Hedley_Ruseckas_Morawska_Wang_Allard_Scherf_Turnbull_Samuel_et
    al._2015, title={Subpicosecond Exciton Dynamics in Polyfluorene Films from Experiment
    and Microscopic Theory}, DOI={<a href="https://doi.org/10.1021/acs.jpcc.5b00680">10.1021/acs.jpcc.5b00680</a>},
    journal={The Journal of Physical Chemistry C}, author={Denis, Jean-Christophe
    and Schumacher, Stefan and Hedley, Gordon J. and Ruseckas, Arvydas and Morawska,
    Paulina O. and Wang, Yue and Allard, Sybille and Scherf, Ullrich and Turnbull,
    Graham A. and Samuel, Ifor D. W. and et al.}, year={2015}, pages={9734–9744} }'
  chicago: Denis, Jean-Christophe, Stefan Schumacher, Gordon J. Hedley, Arvydas Ruseckas,
    Paulina O. Morawska, Yue Wang, Sybille Allard, et al. “Subpicosecond Exciton Dynamics
    in Polyfluorene Films from Experiment and Microscopic Theory.” <i>The Journal
    of Physical Chemistry C</i>, 2015, 9734–44. <a href="https://doi.org/10.1021/acs.jpcc.5b00680">https://doi.org/10.1021/acs.jpcc.5b00680</a>.
  ieee: 'J.-C. Denis <i>et al.</i>, “Subpicosecond Exciton Dynamics in Polyfluorene
    Films from Experiment and Microscopic Theory,” <i>The Journal of Physical Chemistry
    C</i>, pp. 9734–9744, 2015, doi: <a href="https://doi.org/10.1021/acs.jpcc.5b00680">10.1021/acs.jpcc.5b00680</a>.'
  mla: Denis, Jean-Christophe, et al. “Subpicosecond Exciton Dynamics in Polyfluorene
    Films from Experiment and Microscopic Theory.” <i>The Journal of Physical Chemistry
    C</i>, 2015, pp. 9734–44, doi:<a href="https://doi.org/10.1021/acs.jpcc.5b00680">10.1021/acs.jpcc.5b00680</a>.
  short: J.-C. Denis, S. Schumacher, G.J. Hedley, A. Ruseckas, P.O. Morawska, Y. Wang,
    S. Allard, U. Scherf, G.A. Turnbull, I.D.W. Samuel, I. Galbraith, The Journal
    of Physical Chemistry C (2015) 9734–9744.
date_created: 2020-02-10T11:50:44Z
date_updated: 2025-12-05T14:47:36Z
department:
- _id: '15'
- _id: '170'
- _id: '297'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1021/acs.jpcc.5b00680
language:
- iso: eng
page: 9734-9744
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: The Journal of Physical Chemistry C
publication_identifier:
  issn:
  - 1932-7447
  - 1932-7455
publication_status: published
status: public
title: Subpicosecond Exciton Dynamics in Polyfluorene Films from Experiment and Microscopic
  Theory
type: journal_article
user_id: '16199'
year: '2015'
...
---
_id: '15858'
article_number: '083054'
author:
- first_name: Y C
  full_name: Tse, Y C
  last_name: Tse
- first_name: Chris K P
  full_name: Chan, Chris K P
  last_name: Chan
- first_name: M H
  full_name: Luk, M H
  last_name: Luk
- first_name: N H
  full_name: Kwong, N H
  last_name: Kwong
- first_name: P T
  full_name: Leung, P T
  last_name: Leung
- first_name: R
  full_name: Binder, R
  last_name: Binder
- first_name: Stefan
  full_name: Schumacher, Stefan
  id: '27271'
  last_name: Schumacher
  orcid: 0000-0003-4042-4951
citation:
  ama: Tse YC, Chan CKP, Luk MH, et al. A population-competition model for analyzing
    transverse optical patterns including optical control and structural anisotropy.
    <i>New Journal of Physics</i>. Published online 2015. doi:<a href="https://doi.org/10.1088/1367-2630/17/8/083054">10.1088/1367-2630/17/8/083054</a>
  apa: Tse, Y. C., Chan, C. K. P., Luk, M. H., Kwong, N. H., Leung, P. T., Binder,
    R., &#38; Schumacher, S. (2015). A population-competition model for analyzing
    transverse optical patterns including optical control and structural anisotropy.
    <i>New Journal of Physics</i>, Article 083054. <a href="https://doi.org/10.1088/1367-2630/17/8/083054">https://doi.org/10.1088/1367-2630/17/8/083054</a>
  bibtex: '@article{Tse_Chan_Luk_Kwong_Leung_Binder_Schumacher_2015, title={A population-competition
    model for analyzing transverse optical patterns including optical control and
    structural anisotropy}, DOI={<a href="https://doi.org/10.1088/1367-2630/17/8/083054">10.1088/1367-2630/17/8/083054</a>},
    number={083054}, journal={New Journal of Physics}, author={Tse, Y C and Chan,
    Chris K P and Luk, M H and Kwong, N H and Leung, P T and Binder, R and Schumacher,
    Stefan}, year={2015} }'
  chicago: Tse, Y C, Chris K P Chan, M H Luk, N H Kwong, P T Leung, R Binder, and
    Stefan Schumacher. “A Population-Competition Model for Analyzing Transverse Optical
    Patterns Including Optical Control and Structural Anisotropy.” <i>New Journal
    of Physics</i>, 2015. <a href="https://doi.org/10.1088/1367-2630/17/8/083054">https://doi.org/10.1088/1367-2630/17/8/083054</a>.
  ieee: 'Y. C. Tse <i>et al.</i>, “A population-competition model for analyzing transverse
    optical patterns including optical control and structural anisotropy,” <i>New
    Journal of Physics</i>, Art. no. 083054, 2015, doi: <a href="https://doi.org/10.1088/1367-2630/17/8/083054">10.1088/1367-2630/17/8/083054</a>.'
  mla: Tse, Y. C., et al. “A Population-Competition Model for Analyzing Transverse
    Optical Patterns Including Optical Control and Structural Anisotropy.” <i>New
    Journal of Physics</i>, 083054, 2015, doi:<a href="https://doi.org/10.1088/1367-2630/17/8/083054">10.1088/1367-2630/17/8/083054</a>.
  short: Y.C. Tse, C.K.P. Chan, M.H. Luk, N.H. Kwong, P.T. Leung, R. Binder, S. Schumacher,
    New Journal of Physics (2015).
date_created: 2020-02-10T11:49:02Z
date_updated: 2025-12-05T14:46:37Z
department:
- _id: '15'
- _id: '170'
- _id: '297'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1088/1367-2630/17/8/083054
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: New Journal of Physics
publication_identifier:
  issn:
  - 1367-2630
publication_status: published
status: public
title: A population-competition model for analyzing transverse optical patterns including
  optical control and structural anisotropy
type: journal_article
user_id: '16199'
year: '2015'
...
---
_id: '15857'
author:
- first_name: Daniele
  full_name: Di Nuzzo, Daniele
  last_name: Di Nuzzo
- first_name: Claudio
  full_name: Fontanesi, Claudio
  last_name: Fontanesi
- first_name: Rebecca
  full_name: Jones, Rebecca
  last_name: Jones
- first_name: Sybille
  full_name: Allard, Sybille
  last_name: Allard
- first_name: Ines
  full_name: Dumsch, Ines
  last_name: Dumsch
- first_name: Ullrich
  full_name: Scherf, Ullrich
  last_name: Scherf
- first_name: Elizabeth
  full_name: von Hauff, Elizabeth
  last_name: von Hauff
- first_name: Stefan
  full_name: Schumacher, Stefan
  id: '27271'
  last_name: Schumacher
  orcid: 0000-0003-4042-4951
- first_name: Enrico
  full_name: Da Como, Enrico
  last_name: Da Como
citation:
  ama: Di Nuzzo D, Fontanesi C, Jones R, et al. How intermolecular geometrical disorder
    affects the molecular doping of donor–acceptor copolymers. <i>Nature Communications</i>.
    Published online 2015. doi:<a href="https://doi.org/10.1038/ncomms7460">10.1038/ncomms7460</a>
  apa: Di Nuzzo, D., Fontanesi, C., Jones, R., Allard, S., Dumsch, I., Scherf, U.,
    von Hauff, E., Schumacher, S., &#38; Da Como, E. (2015). How intermolecular geometrical
    disorder affects the molecular doping of donor–acceptor copolymers. <i>Nature
    Communications</i>. <a href="https://doi.org/10.1038/ncomms7460">https://doi.org/10.1038/ncomms7460</a>
  bibtex: '@article{Di Nuzzo_Fontanesi_Jones_Allard_Dumsch_Scherf_von Hauff_Schumacher_Da
    Como_2015, title={How intermolecular geometrical disorder affects the molecular
    doping of donor–acceptor copolymers}, DOI={<a href="https://doi.org/10.1038/ncomms7460">10.1038/ncomms7460</a>},
    journal={Nature Communications}, author={Di Nuzzo, Daniele and Fontanesi, Claudio
    and Jones, Rebecca and Allard, Sybille and Dumsch, Ines and Scherf, Ullrich and
    von Hauff, Elizabeth and Schumacher, Stefan and Da Como, Enrico}, year={2015}
    }'
  chicago: Di Nuzzo, Daniele, Claudio Fontanesi, Rebecca Jones, Sybille Allard, Ines
    Dumsch, Ullrich Scherf, Elizabeth von Hauff, Stefan Schumacher, and Enrico Da
    Como. “How Intermolecular Geometrical Disorder Affects the Molecular Doping of
    Donor–Acceptor Copolymers.” <i>Nature Communications</i>, 2015. <a href="https://doi.org/10.1038/ncomms7460">https://doi.org/10.1038/ncomms7460</a>.
  ieee: 'D. Di Nuzzo <i>et al.</i>, “How intermolecular geometrical disorder affects
    the molecular doping of donor–acceptor copolymers,” <i>Nature Communications</i>,
    2015, doi: <a href="https://doi.org/10.1038/ncomms7460">10.1038/ncomms7460</a>.'
  mla: Di Nuzzo, Daniele, et al. “How Intermolecular Geometrical Disorder Affects
    the Molecular Doping of Donor–Acceptor Copolymers.” <i>Nature Communications</i>,
    2015, doi:<a href="https://doi.org/10.1038/ncomms7460">10.1038/ncomms7460</a>.
  short: D. Di Nuzzo, C. Fontanesi, R. Jones, S. Allard, I. Dumsch, U. Scherf, E.
    von Hauff, S. Schumacher, E. Da Como, Nature Communications (2015).
date_created: 2020-02-10T11:48:09Z
date_updated: 2025-12-05T14:46:07Z
department:
- _id: '15'
- _id: '170'
- _id: '297'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1038/ncomms7460
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Nature Communications
publication_identifier:
  issn:
  - 2041-1723
publication_status: published
status: public
title: How intermolecular geometrical disorder affects the molecular doping of donor–acceptor
  copolymers
type: journal_article
user_id: '16199'
year: '2015'
...
---
_id: '15859'
author:
- first_name: Johannes
  full_name: Schmutzler, Johannes
  last_name: Schmutzler
- first_name: Przemyslaw
  full_name: Lewandowski, Przemyslaw
  last_name: Lewandowski
- first_name: Marc
  full_name: Aßmann, Marc
  last_name: Aßmann
- first_name: Dominik
  full_name: Niemietz, Dominik
  last_name: Niemietz
- first_name: Stefan
  full_name: Schumacher, Stefan
  id: '27271'
  last_name: Schumacher
  orcid: 0000-0003-4042-4951
- first_name: Martin
  full_name: Kamp, Martin
  last_name: Kamp
- first_name: Christian
  full_name: Schneider, Christian
  last_name: Schneider
- first_name: Sven
  full_name: Höfling, Sven
  last_name: Höfling
- first_name: Manfred
  full_name: Bayer, Manfred
  last_name: Bayer
citation:
  ama: Schmutzler J, Lewandowski P, Aßmann M, et al. All-optical flow control of a
    polariton condensate using nonresonant excitation. <i>Physical Review B</i>. Published
    online 2015. doi:<a href="https://doi.org/10.1103/physrevb.91.195308">10.1103/physrevb.91.195308</a>
  apa: Schmutzler, J., Lewandowski, P., Aßmann, M., Niemietz, D., Schumacher, S.,
    Kamp, M., Schneider, C., Höfling, S., &#38; Bayer, M. (2015). All-optical flow
    control of a polariton condensate using nonresonant excitation. <i>Physical Review
    B</i>. <a href="https://doi.org/10.1103/physrevb.91.195308">https://doi.org/10.1103/physrevb.91.195308</a>
  bibtex: '@article{Schmutzler_Lewandowski_Aßmann_Niemietz_Schumacher_Kamp_Schneider_Höfling_Bayer_2015,
    title={All-optical flow control of a polariton condensate using nonresonant excitation},
    DOI={<a href="https://doi.org/10.1103/physrevb.91.195308">10.1103/physrevb.91.195308</a>},
    journal={Physical Review B}, author={Schmutzler, Johannes and Lewandowski, Przemyslaw
    and Aßmann, Marc and Niemietz, Dominik and Schumacher, Stefan and Kamp, Martin
    and Schneider, Christian and Höfling, Sven and Bayer, Manfred}, year={2015} }'
  chicago: Schmutzler, Johannes, Przemyslaw Lewandowski, Marc Aßmann, Dominik Niemietz,
    Stefan Schumacher, Martin Kamp, Christian Schneider, Sven Höfling, and Manfred
    Bayer. “All-Optical Flow Control of a Polariton Condensate Using Nonresonant Excitation.”
    <i>Physical Review B</i>, 2015. <a href="https://doi.org/10.1103/physrevb.91.195308">https://doi.org/10.1103/physrevb.91.195308</a>.
  ieee: 'J. Schmutzler <i>et al.</i>, “All-optical flow control of a polariton condensate
    using nonresonant excitation,” <i>Physical Review B</i>, 2015, doi: <a href="https://doi.org/10.1103/physrevb.91.195308">10.1103/physrevb.91.195308</a>.'
  mla: Schmutzler, Johannes, et al. “All-Optical Flow Control of a Polariton Condensate
    Using Nonresonant Excitation.” <i>Physical Review B</i>, 2015, doi:<a href="https://doi.org/10.1103/physrevb.91.195308">10.1103/physrevb.91.195308</a>.
  short: J. Schmutzler, P. Lewandowski, M. Aßmann, D. Niemietz, S. Schumacher, M.
    Kamp, C. Schneider, S. Höfling, M. Bayer, Physical Review B (2015).
date_created: 2020-02-10T11:49:53Z
date_updated: 2025-12-05T14:47:05Z
department:
- _id: '15'
- _id: '170'
- _id: '297'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1103/physrevb.91.195308
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Physical Review B
publication_identifier:
  issn:
  - 1098-0121
  - 1550-235X
publication_status: published
status: public
title: All-optical flow control of a polariton condensate using nonresonant excitation
type: journal_article
user_id: '16199'
year: '2015'
...
---
_id: '13818'
author:
- first_name: Adam
  full_name: Neuba, Adam
  last_name: Neuba
- first_name: Martin
  full_name: Rohrmüller, Martin
  last_name: Rohrmüller
- first_name: Rebecca
  full_name: Hölscher, Rebecca
  last_name: Hölscher
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: Gerald
  full_name: Henkel, Gerald
  last_name: Henkel
citation:
  ama: 'Neuba A, Rohrmüller M, Hölscher R, Schmidt WG, Henkel G. A panel of peralkylated
    sulfur–guanidine type bases: Novel pro-ligands for use in biomimetic coordination
    chemistry. <i>Inorganica Chimica Acta</i>. 2015;430:225-238. doi:<a href="https://doi.org/10.1016/j.ica.2015.03.015">10.1016/j.ica.2015.03.015</a>'
  apa: 'Neuba, A., Rohrmüller, M., Hölscher, R., Schmidt, W. G., &#38; Henkel, G.
    (2015). A panel of peralkylated sulfur–guanidine type bases: Novel pro-ligands
    for use in biomimetic coordination chemistry. <i>Inorganica Chimica Acta</i>,
    <i>430</i>, 225–238. <a href="https://doi.org/10.1016/j.ica.2015.03.015">https://doi.org/10.1016/j.ica.2015.03.015</a>'
  bibtex: '@article{Neuba_Rohrmüller_Hölscher_Schmidt_Henkel_2015, title={A panel
    of peralkylated sulfur–guanidine type bases: Novel pro-ligands for use in biomimetic
    coordination chemistry}, volume={430}, DOI={<a href="https://doi.org/10.1016/j.ica.2015.03.015">10.1016/j.ica.2015.03.015</a>},
    journal={Inorganica Chimica Acta}, author={Neuba, Adam and Rohrmüller, Martin
    and Hölscher, Rebecca and Schmidt, Wolf Gero and Henkel, Gerald}, year={2015},
    pages={225–238} }'
  chicago: 'Neuba, Adam, Martin Rohrmüller, Rebecca Hölscher, Wolf Gero Schmidt, and
    Gerald Henkel. “A Panel of Peralkylated Sulfur–Guanidine Type Bases: Novel pro-Ligands
    for Use in Biomimetic Coordination Chemistry.” <i>Inorganica Chimica Acta</i>
    430 (2015): 225–38. <a href="https://doi.org/10.1016/j.ica.2015.03.015">https://doi.org/10.1016/j.ica.2015.03.015</a>.'
  ieee: 'A. Neuba, M. Rohrmüller, R. Hölscher, W. G. Schmidt, and G. Henkel, “A panel
    of peralkylated sulfur–guanidine type bases: Novel pro-ligands for use in biomimetic
    coordination chemistry,” <i>Inorganica Chimica Acta</i>, vol. 430, pp. 225–238,
    2015, doi: <a href="https://doi.org/10.1016/j.ica.2015.03.015">10.1016/j.ica.2015.03.015</a>.'
  mla: 'Neuba, Adam, et al. “A Panel of Peralkylated Sulfur–Guanidine Type Bases:
    Novel pro-Ligands for Use in Biomimetic Coordination Chemistry.” <i>Inorganica
    Chimica Acta</i>, vol. 430, 2015, pp. 225–38, doi:<a href="https://doi.org/10.1016/j.ica.2015.03.015">10.1016/j.ica.2015.03.015</a>.'
  short: A. Neuba, M. Rohrmüller, R. Hölscher, W.G. Schmidt, G. Henkel, Inorganica
    Chimica Acta 430 (2015) 225–238.
date_created: 2019-10-15T06:33:12Z
date_updated: 2025-12-16T07:53:28Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '2'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1016/j.ica.2015.03.015
funded_apc: '1'
intvolume: '       430'
language:
- iso: eng
page: 225-238
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Inorganica Chimica Acta
publication_identifier:
  issn:
  - 0020-1693
publication_status: published
status: public
title: 'A panel of peralkylated sulfur–guanidine type bases: Novel pro-ligands for
  use in biomimetic coordination chemistry'
type: journal_article
user_id: '16199'
volume: 430
year: '2015'
...