---
_id: '24'
author:
- first_name: Tobias
  full_name: Kenter, Tobias
  id: '3145'
  last_name: Kenter
- first_name: Christian
  full_name: Plessl, Christian
  id: '16153'
  last_name: Plessl
  orcid: 0000-0001-5728-9982
citation:
  ama: 'Kenter T, Plessl C. Microdisk Cavity FDTD Simulation on FPGA using OpenCL.
    In: <i>Proc. Workshop on Heterogeneous High-Performance Reconfigurable Computing
    (H2RC)</i>. ; 2016.'
  apa: Kenter, T., &#38; Plessl, C. (2016). Microdisk Cavity FDTD Simulation on FPGA
    using OpenCL. <i>Proc. Workshop on Heterogeneous High-Performance Reconfigurable
    Computing (H2RC)</i>.
  bibtex: '@inproceedings{Kenter_Plessl_2016, title={Microdisk Cavity FDTD Simulation
    on FPGA using OpenCL}, booktitle={Proc. Workshop on Heterogeneous High-performance
    Reconfigurable Computing (H2RC)}, author={Kenter, Tobias and Plessl, Christian},
    year={2016} }'
  chicago: Kenter, Tobias, and Christian Plessl. “Microdisk Cavity FDTD Simulation
    on FPGA Using OpenCL.” In <i>Proc. Workshop on Heterogeneous High-Performance
    Reconfigurable Computing (H2RC)</i>, 2016.
  ieee: T. Kenter and C. Plessl, “Microdisk Cavity FDTD Simulation on FPGA using OpenCL,”
    2016.
  mla: Kenter, Tobias, and Christian Plessl. “Microdisk Cavity FDTD Simulation on
    FPGA Using OpenCL.” <i>Proc. Workshop on Heterogeneous High-Performance Reconfigurable
    Computing (H2RC)</i>, 2016.
  short: 'T. Kenter, C. Plessl, in: Proc. Workshop on Heterogeneous High-Performance
    Reconfigurable Computing (H2RC), 2016.'
date_created: 2017-07-26T15:00:43Z
date_updated: 2023-09-26T13:26:17Z
ddc:
- '004'
department:
- _id: '27'
- _id: '518'
file:
- access_level: closed
  content_type: application/pdf
  creator: kenter
  date_created: 2018-11-14T12:38:45Z
  date_updated: 2018-11-14T12:38:45Z
  file_id: '5602'
  file_name: paper_26.pdf
  file_size: 129552
  relation: main_file
  success: 1
file_date_updated: 2018-11-14T12:38:45Z
has_accepted_license: '1'
language:
- iso: eng
project:
- _id: '32'
  grant_number: PL 595/2-1 / 320898746
  name: Performance and Efficiency in HPC with Custom Computing
- _id: '1'
  grant_number: '160364472'
  name: SFB 901
- _id: '4'
  name: SFB 901 - Project Area C
- _id: '14'
  grant_number: '160364472'
  name: SFB 901 - Subproject C2
publication: Proc. Workshop on Heterogeneous High-performance Reconfigurable Computing
  (H2RC)
quality_controlled: '1'
status: public
title: Microdisk Cavity FDTD Simulation on FPGA using OpenCL
type: conference
user_id: '15278'
year: '2016'
...
---
_id: '25'
author:
- first_name: Michael
  full_name: Lass, Michael
  id: '24135'
  last_name: Lass
  orcid: 0000-0002-5708-7632
- first_name: Thomas
  full_name: Kühne, Thomas
  id: '49079'
  last_name: Kühne
- first_name: Christian
  full_name: Plessl, Christian
  id: '16153'
  last_name: Plessl
  orcid: 0000-0001-5728-9982
citation:
  ama: 'Lass M, Kühne T, Plessl C. Using Approximate Computing in Scientific Codes.
    In: <i>Workshop on Approximate Computing (AC)</i>. ; 2016.'
  apa: Lass, M., Kühne, T., &#38; Plessl, C. (2016). Using Approximate Computing in
    Scientific Codes. <i>Workshop on Approximate Computing (AC)</i>.
  bibtex: '@inproceedings{Lass_Kühne_Plessl_2016, title={Using Approximate Computing
    in Scientific Codes}, booktitle={Workshop on Approximate Computing (AC)}, author={Lass,
    Michael and Kühne, Thomas and Plessl, Christian}, year={2016} }'
  chicago: Lass, Michael, Thomas Kühne, and Christian Plessl. “Using Approximate Computing
    in Scientific Codes.” In <i>Workshop on Approximate Computing (AC)</i>, 2016.
  ieee: M. Lass, T. Kühne, and C. Plessl, “Using Approximate Computing in Scientific
    Codes,” 2016.
  mla: Lass, Michael, et al. “Using Approximate Computing in Scientific Codes.” <i>Workshop
    on Approximate Computing (AC)</i>, 2016.
  short: 'M. Lass, T. Kühne, C. Plessl, in: Workshop on Approximate Computing (AC),
    2016.'
date_created: 2017-07-26T15:02:20Z
date_updated: 2023-09-26T13:25:17Z
department:
- _id: '27'
- _id: '518'
- _id: '304'
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Workshop on Approximate Computing (AC)
quality_controlled: '1'
status: public
title: Using Approximate Computing in Scientific Codes
type: conference
user_id: '15278'
year: '2016'
...
---
_id: '138'
abstract:
- lang: eng
  text: Hardware accelerators are becoming popular in academia and industry. To move
    one step further from the state-of-the-art multicore plus accelerator approaches,
    we present in this paper our innovative SAVEHSA architecture. It comprises of
    a heterogeneous hardware platform with three different high-end accelerators attached
    over PCIe (GPGPU, FPGA and Intel MIC). Such systems can process parallel workloads
    very efficiently whilst being more energy efficient than regular CPU systems.
    To leverage the heterogeneity, the workload has to be distributed among the computing
    units in a way that each unit is well-suited for the assigned task and executable
    code must be available. To tackle this problem we present two software components;
    the first can perform resource allocation at runtime while respecting system and
    application goals (in terms of throughput, energy, latency, etc.) and the second
    is able to analyze an application and generate executable code for an accelerator
    at runtime. We demonstrate the first proof-of-concept implementation of our framework
    on the heterogeneous platform, discuss different runtime policies and measure
    the introduced overheads.
author:
- 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
- first_name: 'Ettore M. G. '
  full_name: 'Trainiti, Ettore M. G. '
  last_name: Trainiti
- first_name: Gianluca C.
  full_name: Durelli, Gianluca C.
  last_name: Durelli
- first_name: Emanuele
  full_name: Del Sozzo, Emanuele
  last_name: Del Sozzo
- first_name: 'Marco D. '
  full_name: 'Santambrogio, Marco D. '
  last_name: Santambrogio
- first_name: Christina
  full_name: Bolchini, Christina
  last_name: Bolchini
citation:
  ama: 'Riebler H, Vaz GF, Plessl C, et al. Using Just-in-Time Code Generation for
    Transparent Resource Management in Heterogeneous Systems. In: <i>Proceedings of
    International Forum on Research and Technologies for Society and Industry (RTSI)</i>.
    IEEE; 2016:1-5. doi:<a href="https://doi.org/10.1109/RTSI.2016.7740545">10.1109/RTSI.2016.7740545</a>'
  apa: Riebler, H., Vaz, G. F., Plessl, C., Trainiti, E. M. G., Durelli, G. C., Del
    Sozzo, E., Santambrogio, M. D., &#38; Bolchini, C. (2016). Using Just-in-Time
    Code Generation for Transparent Resource Management in Heterogeneous Systems.
    <i>Proceedings of International Forum on Research and Technologies for Society
    and Industry (RTSI)</i>, 1–5. <a href="https://doi.org/10.1109/RTSI.2016.7740545">https://doi.org/10.1109/RTSI.2016.7740545</a>
  bibtex: '@inproceedings{Riebler_Vaz_Plessl_Trainiti_Durelli_Del Sozzo_Santambrogio_Bolchini_2016,
    title={Using Just-in-Time Code Generation for Transparent Resource Management
    in Heterogeneous Systems}, DOI={<a href="https://doi.org/10.1109/RTSI.2016.7740545">10.1109/RTSI.2016.7740545</a>},
    booktitle={Proceedings of International Forum on Research and Technologies for
    Society and Industry (RTSI)}, publisher={IEEE}, author={Riebler, Heinrich and
    Vaz, Gavin Francis and Plessl, Christian and Trainiti, Ettore M. G.  and Durelli,
    Gianluca C. and Del Sozzo, Emanuele and Santambrogio, Marco D.  and Bolchini,
    Christina}, year={2016}, pages={1–5} }'
  chicago: Riebler, Heinrich, Gavin Francis Vaz, Christian Plessl, Ettore M. G.  Trainiti,
    Gianluca C. Durelli, Emanuele Del Sozzo, Marco D.  Santambrogio, and Christina
    Bolchini. “Using Just-in-Time Code Generation for Transparent Resource Management
    in Heterogeneous Systems.” In <i>Proceedings of International Forum on Research
    and Technologies for Society and Industry (RTSI)</i>, 1–5. IEEE, 2016. <a href="https://doi.org/10.1109/RTSI.2016.7740545">https://doi.org/10.1109/RTSI.2016.7740545</a>.
  ieee: 'H. Riebler <i>et al.</i>, “Using Just-in-Time Code Generation for Transparent
    Resource Management in Heterogeneous Systems,” in <i>Proceedings of International
    Forum on Research and Technologies for Society and Industry (RTSI)</i>, 2016,
    pp. 1–5, doi: <a href="https://doi.org/10.1109/RTSI.2016.7740545">10.1109/RTSI.2016.7740545</a>.'
  mla: Riebler, Heinrich, et al. “Using Just-in-Time Code Generation for Transparent
    Resource Management in Heterogeneous Systems.” <i>Proceedings of International
    Forum on Research and Technologies for Society and Industry (RTSI)</i>, IEEE,
    2016, pp. 1–5, doi:<a href="https://doi.org/10.1109/RTSI.2016.7740545">10.1109/RTSI.2016.7740545</a>.
  short: 'H. Riebler, G.F. Vaz, C. Plessl, E.M.G. Trainiti, G.C. Durelli, E. Del Sozzo,
    M.D. Santambrogio, C. Bolchini, in: Proceedings of International Forum on Research
    and Technologies for Society and Industry (RTSI), IEEE, 2016, pp. 1–5.'
date_created: 2017-10-17T12:41:18Z
date_updated: 2023-09-26T13:28:11Z
ddc:
- '040'
department:
- _id: '27'
- _id: '518'
doi: 10.1109/RTSI.2016.7740545
file:
- access_level: closed
  content_type: application/pdf
  creator: florida
  date_created: 2018-03-21T13:01:09Z
  date_updated: 2018-03-21T13:01:09Z
  file_id: '1560'
  file_name: 138-07740545.pdf
  file_size: 184334
  relation: main_file
  success: 1
file_date_updated: 2018-03-21T13:01:09Z
has_accepted_license: '1'
language:
- iso: eng
page: 1-5
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 International Forum on Research and Technologies for Society
  and Industry (RTSI)
publisher: IEEE
quality_controlled: '1'
status: public
title: Using Just-in-Time Code Generation for Transparent Resource Management in Heterogeneous
  Systems
type: conference
user_id: '15278'
year: '2016'
...
---
_id: '156'
abstract:
- lang: eng
  text: Many modern compute nodes are heterogeneous multi-cores that integrate several
    CPU cores with fixed function or reconfigurable hardware cores. Such systems need
    to adapt task scheduling and mapping to optimise for performance and energy under
    varying workloads and, increasingly important, for thermal and fault management
    and are thus relevant targets for self-aware computing. In this chapter, we take
    up the generic reference architecture for designing self-aware and self-expressive
    computing systems and refine it for heterogeneous multi-cores. We present ReconOS,
    an architecture, programming model and execution environment for heterogeneous
    multi-cores, and show how the components of the reference architecture can be
    implemented on top of ReconOS. In particular, the unique feature of dynamic partial
    reconfiguration supports self-expression through starting and terminating reconfigurable
    hardware cores. We detail a case study that runs two applications on an architecture
    with one CPU and 12 reconfigurable hardware cores and present self-expression
    strategies for adapting under performance, temperature and even conflicting constraints.
    The case study demonstrates that the reference architecture as a model for self-aware
    computing is highly useful as it allows us to structure and simplify the design
    process, which will be essential for designing complex future compute nodes. Furthermore,
    ReconOS is used as a base technology for flexible protocol stacks in Chapter 10,
    an approach for self-aware computing at the networking level.
author:
- first_name: Andreas
  full_name: Agne, Andreas
  last_name: Agne
- first_name: Markus
  full_name: Happe, Markus
  last_name: Happe
- first_name: Achim
  full_name: Lösch, Achim
  id: '43646'
  last_name: Lösch
- first_name: Christian
  full_name: Plessl, Christian
  id: '16153'
  last_name: Plessl
  orcid: 0000-0001-5728-9982
- first_name: Marco
  full_name: Platzner, Marco
  id: '398'
  last_name: Platzner
citation:
  ama: 'Agne A, Happe M, Lösch A, Plessl C, Platzner M. Self-aware Compute Nodes.
    In: <i>Self-Aware Computing Systems</i>. Natural Computing Series (NCS). Springer
    International Publishing; 2016:145-165. doi:<a href="https://doi.org/10.1007/978-3-319-39675-0_8">10.1007/978-3-319-39675-0_8</a>'
  apa: Agne, A., Happe, M., Lösch, A., Plessl, C., &#38; Platzner, M. (2016). Self-aware
    Compute Nodes. In <i>Self-aware Computing Systems</i> (pp. 145–165). Springer
    International Publishing. <a href="https://doi.org/10.1007/978-3-319-39675-0_8">https://doi.org/10.1007/978-3-319-39675-0_8</a>
  bibtex: '@inbook{Agne_Happe_Lösch_Plessl_Platzner_2016, place={Cham}, series={Natural
    Computing Series (NCS)}, title={Self-aware Compute Nodes}, DOI={<a href="https://doi.org/10.1007/978-3-319-39675-0_8">10.1007/978-3-319-39675-0_8</a>},
    booktitle={Self-aware Computing Systems}, publisher={Springer International Publishing},
    author={Agne, Andreas and Happe, Markus and Lösch, Achim and Plessl, Christian
    and Platzner, Marco}, year={2016}, pages={145–165}, collection={Natural Computing
    Series (NCS)} }'
  chicago: 'Agne, Andreas, Markus Happe, Achim Lösch, Christian Plessl, and Marco
    Platzner. “Self-Aware Compute Nodes.” In <i>Self-Aware Computing Systems</i>,
    145–65. Natural Computing Series (NCS). Cham: Springer International Publishing,
    2016. <a href="https://doi.org/10.1007/978-3-319-39675-0_8">https://doi.org/10.1007/978-3-319-39675-0_8</a>.'
  ieee: 'A. Agne, M. Happe, A. Lösch, C. Plessl, and M. Platzner, “Self-aware Compute
    Nodes,” in <i>Self-aware Computing Systems</i>, Cham: Springer International Publishing,
    2016, pp. 145–165.'
  mla: Agne, Andreas, et al. “Self-Aware Compute Nodes.” <i>Self-Aware Computing Systems</i>,
    Springer International Publishing, 2016, pp. 145–65, doi:<a href="https://doi.org/10.1007/978-3-319-39675-0_8">10.1007/978-3-319-39675-0_8</a>.
  short: 'A. Agne, M. Happe, A. Lösch, C. Plessl, M. Platzner, in: Self-Aware Computing
    Systems, Springer International Publishing, Cham, 2016, pp. 145–165.'
date_created: 2017-10-17T12:41:22Z
date_updated: 2023-09-26T13:27:44Z
ddc:
- '040'
department:
- _id: '518'
- _id: '27'
- _id: '78'
doi: 10.1007/978-3-319-39675-0_8
file:
- access_level: closed
  content_type: application/pdf
  creator: aloesch
  date_created: 2018-11-14T13:20:32Z
  date_updated: 2018-11-14T13:20:32Z
  file_id: '5613'
  file_name: chapter8.pdf
  file_size: 833054
  relation: main_file
  success: 1
file_date_updated: 2018-11-14T13:20:32Z
has_accepted_license: '1'
language:
- iso: eng
page: 145-165
place: Cham
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: '31'
  grant_number: '257906'
  name: Engineering Proprioception in Computing Systems
publication: Self-aware Computing Systems
publisher: Springer International Publishing
quality_controlled: '1'
series_title: Natural Computing Series (NCS)
status: public
title: Self-aware Compute Nodes
type: book_chapter
user_id: '15278'
year: '2016'
...
---
_id: '165'
abstract:
- lang: eng
  text: A broad spectrum of applications can be accelerated by offloading computation
    intensive parts to reconfigurable hardware. However, to achieve speedups, the
    number of loop it- erations (trip count) needs to be sufficiently large to amortize
    offloading overheads. Trip counts are frequently not known at compile time, but
    only at runtime just before entering a loop. Therefore, we propose to generate
    code for both the CPU and the coprocessor, and defer the offloading decision to
    the application runtime. We demonstrate how a toolflow, based on the LLVM compiler
    framework, can automatically embed dynamic offloading de- cisions into the application
    code. We perform in-depth static and dynamic analysis of pop- ular benchmarks,
    which confirm the general potential of such an approach. We also pro- pose to
    optimize the offloading process by decoupling the runtime decision from the loop
    execution (decision slack). The feasibility of our approach is demonstrated by
    a toolflow that automatically identifies suitable data-parallel loops and generates
    code for the FPGA coprocessor of a Convey HC-1. We evaluate the integrated toolflow
    with representative loops executed for different input data sizes.
author:
- first_name: Gavin Francis
  full_name: Vaz, Gavin Francis
  id: '30332'
  last_name: Vaz
- first_name: Heinrich
  full_name: Riebler, Heinrich
  id: '8961'
  last_name: Riebler
- first_name: Tobias
  full_name: Kenter, Tobias
  id: '3145'
  last_name: Kenter
- first_name: Christian
  full_name: Plessl, Christian
  id: '16153'
  last_name: Plessl
  orcid: 0000-0001-5728-9982
citation:
  ama: Vaz GF, Riebler H, Kenter T, Plessl C. Potential and Methods for Embedding
    Dynamic Offloading Decisions into Application Code. <i>Computers and Electrical
    Engineering</i>. 2016;55:91-111. doi:<a href="https://doi.org/10.1016/j.compeleceng.2016.04.021">10.1016/j.compeleceng.2016.04.021</a>
  apa: Vaz, G. F., Riebler, H., Kenter, T., &#38; Plessl, C. (2016). Potential and
    Methods for Embedding Dynamic Offloading Decisions into Application Code. <i>Computers
    and Electrical Engineering</i>, <i>55</i>, 91–111. <a href="https://doi.org/10.1016/j.compeleceng.2016.04.021">https://doi.org/10.1016/j.compeleceng.2016.04.021</a>
  bibtex: '@article{Vaz_Riebler_Kenter_Plessl_2016, title={Potential and Methods for
    Embedding Dynamic Offloading Decisions into Application Code}, volume={55}, DOI={<a
    href="https://doi.org/10.1016/j.compeleceng.2016.04.021">10.1016/j.compeleceng.2016.04.021</a>},
    journal={Computers and Electrical Engineering}, publisher={Elsevier}, author={Vaz,
    Gavin Francis and Riebler, Heinrich and Kenter, Tobias and Plessl, Christian},
    year={2016}, pages={91–111} }'
  chicago: 'Vaz, Gavin Francis, Heinrich Riebler, Tobias Kenter, and Christian Plessl.
    “Potential and Methods for Embedding Dynamic Offloading Decisions into Application
    Code.” <i>Computers and Electrical Engineering</i> 55 (2016): 91–111. <a href="https://doi.org/10.1016/j.compeleceng.2016.04.021">https://doi.org/10.1016/j.compeleceng.2016.04.021</a>.'
  ieee: 'G. F. Vaz, H. Riebler, T. Kenter, and C. Plessl, “Potential and Methods for
    Embedding Dynamic Offloading Decisions into Application Code,” <i>Computers and
    Electrical Engineering</i>, vol. 55, pp. 91–111, 2016, doi: <a href="https://doi.org/10.1016/j.compeleceng.2016.04.021">10.1016/j.compeleceng.2016.04.021</a>.'
  mla: Vaz, Gavin Francis, et al. “Potential and Methods for Embedding Dynamic Offloading
    Decisions into Application Code.” <i>Computers and Electrical Engineering</i>,
    vol. 55, Elsevier, 2016, pp. 91–111, doi:<a href="https://doi.org/10.1016/j.compeleceng.2016.04.021">10.1016/j.compeleceng.2016.04.021</a>.
  short: G.F. Vaz, H. Riebler, T. Kenter, C. Plessl, Computers and Electrical Engineering
    55 (2016) 91–111.
date_created: 2017-10-17T12:41:24Z
date_updated: 2023-09-26T13:26:38Z
ddc:
- '040'
department:
- _id: '27'
- _id: '518'
doi: 10.1016/j.compeleceng.2016.04.021
file:
- access_level: closed
  content_type: application/pdf
  creator: florida
  date_created: 2018-03-21T12:45:47Z
  date_updated: 2018-03-21T12:45:47Z
  file_id: '1544'
  file_name: 165-1-s2.0-S0045790616301021-main.pdf
  file_size: 3037854
  relation: main_file
  success: 1
file_date_updated: 2018-03-21T12:45:47Z
has_accepted_license: '1'
intvolume: '        55'
language:
- iso: eng
page: 91-111
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: Computers and Electrical Engineering
publication_identifier:
  issn:
  - 0045-7906
publisher: Elsevier
quality_controlled: '1'
status: public
title: Potential and Methods for Embedding Dynamic Offloading Decisions into Application
  Code
type: journal_article
user_id: '15278'
volume: 55
year: '2016'
...
---
_id: '168'
abstract:
- lang: eng
  text: The use of heterogeneous computing resources, such as Graphic Processing Units
    or other specialized coprocessors, has become widespread in recent years because
    of their per- formance and energy efficiency advantages. Approaches for managing
    and scheduling tasks to heterogeneous resources are still subject to research.
    Although queuing systems have recently been extended to support accelerator resources,
    a general solution that manages heterogeneous resources at the operating system-
    level to exploit a global view of the system state is still missing.In this paper
    we present a user space scheduler that enables task scheduling and migration on
    heterogeneous processing resources in Linux. Using run queues for available resources
    we perform scheduling decisions based on the system state and on task characterization
    from earlier measurements. With a pro- gramming pattern that supports the integration
    of checkpoints into applications, we preempt tasks and migrate them between three
    very different compute resources. Considering static and dynamic workload scenarios,
    we show that this approach can gain up to 17% performance, on average 7%, by effectively
    avoiding idle resources. We demonstrate that a work-conserving strategy without
    migration is no suitable alternative.
author:
- first_name: Achim
  full_name: Lösch, Achim
  id: '43646'
  last_name: Lösch
- first_name: Tobias
  full_name: Beisel, Tobias
  last_name: Beisel
- first_name: Tobias
  full_name: Kenter, Tobias
  id: '3145'
  last_name: Kenter
- first_name: Christian
  full_name: Plessl, Christian
  id: '16153'
  last_name: Plessl
  orcid: 0000-0001-5728-9982
- first_name: Marco
  full_name: Platzner, Marco
  id: '398'
  last_name: Platzner
citation:
  ama: 'Lösch A, Beisel T, Kenter T, Plessl C, Platzner M. Performance-centric scheduling
    with task migration for a heterogeneous compute node in the data center. In: <i>Proceedings
    of the 2016 Design, Automation &#38; Test in Europe Conference &#38; Exhibition
    (DATE)</i>. EDA Consortium / IEEE; 2016:912-917.'
  apa: Lösch, A., Beisel, T., Kenter, T., Plessl, C., &#38; Platzner, M. (2016). Performance-centric
    scheduling with task migration for a heterogeneous compute node in the data center.
    <i>Proceedings of the 2016 Design, Automation &#38; Test in Europe Conference
    &#38; Exhibition (DATE)</i>, 912–917.
  bibtex: '@inproceedings{Lösch_Beisel_Kenter_Plessl_Platzner_2016, title={Performance-centric
    scheduling with task migration for a heterogeneous compute node in the data center},
    booktitle={Proceedings of the 2016 Design, Automation &#38; Test in Europe Conference
    &#38; Exhibition (DATE)}, publisher={EDA Consortium / IEEE}, author={Lösch, Achim
    and Beisel, Tobias and Kenter, Tobias and Plessl, Christian and Platzner, Marco},
    year={2016}, pages={912–917} }'
  chicago: Lösch, Achim, Tobias Beisel, Tobias Kenter, Christian Plessl, and Marco
    Platzner. “Performance-Centric Scheduling with Task Migration for a Heterogeneous
    Compute Node in the Data Center.” In <i>Proceedings of the 2016 Design, Automation
    &#38; Test in Europe Conference &#38; Exhibition (DATE)</i>, 912–17. EDA Consortium
    / IEEE, 2016.
  ieee: A. Lösch, T. Beisel, T. Kenter, C. Plessl, and M. Platzner, “Performance-centric
    scheduling with task migration for a heterogeneous compute node in the data center,”
    in <i>Proceedings of the 2016 Design, Automation &#38; Test in Europe Conference
    &#38; Exhibition (DATE)</i>, 2016, pp. 912–917.
  mla: Lösch, Achim, et al. “Performance-Centric Scheduling with Task Migration for
    a Heterogeneous Compute Node in the Data Center.” <i>Proceedings of the 2016 Design,
    Automation &#38; Test in Europe Conference &#38; Exhibition (DATE)</i>, EDA Consortium
    / IEEE, 2016, pp. 912–17.
  short: 'A. Lösch, T. Beisel, T. Kenter, C. Plessl, M. Platzner, in: Proceedings
    of the 2016 Design, Automation &#38; Test in Europe Conference &#38; Exhibition
    (DATE), EDA Consortium / IEEE, 2016, pp. 912–917.'
date_created: 2017-10-17T12:41:24Z
date_updated: 2023-09-26T13:27:00Z
ddc:
- '040'
department:
- _id: '27'
- _id: '518'
- _id: '78'
file:
- access_level: closed
  content_type: application/pdf
  creator: florida
  date_created: 2018-03-21T12:41:55Z
  date_updated: 2018-03-21T12:41:55Z
  file_id: '1541'
  file_name: 168-07459438.pdf
  file_size: 261356
  relation: main_file
  success: 1
file_date_updated: 2018-03-21T12:41:55Z
has_accepted_license: '1'
language:
- iso: eng
page: 912-917
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: '30'
  grant_number: 01|H11004A
  name: Enabling Heterogeneous Hardware Acceleration using Novel Programming and Scheduling
    Models
publication: Proceedings of the 2016 Design, Automation & Test in Europe Conference
  & Exhibition (DATE)
publisher: EDA Consortium / IEEE
quality_controlled: '1'
status: public
title: Performance-centric scheduling with task migration for a heterogeneous compute
  node in the data center
type: conference
user_id: '15278'
year: '2016'
...
---
_id: '171'
author:
- first_name: Tobias
  full_name: Kenter, Tobias
  id: '3145'
  last_name: Kenter
- first_name: Gavin Francis
  full_name: Vaz, Gavin Francis
  id: '30332'
  last_name: Vaz
- first_name: Heinrich
  full_name: Riebler, Heinrich
  id: '8961'
  last_name: Riebler
- first_name: Christian
  full_name: Plessl, Christian
  id: '16153'
  last_name: Plessl
  orcid: 0000-0001-5728-9982
citation:
  ama: 'Kenter T, Vaz GF, Riebler H, Plessl C. Opportunities for deferring application
    partitioning and accelerator synthesis to runtime (extended abstract). In: <i>Workshop
    on Reconfigurable Computing (WRC)</i>. ; 2016.'
  apa: Kenter, T., Vaz, G. F., Riebler, H., &#38; Plessl, C. (2016). Opportunities
    for deferring application partitioning and accelerator synthesis to runtime (extended
    abstract). <i>Workshop on Reconfigurable Computing (WRC)</i>.
  bibtex: '@inproceedings{Kenter_Vaz_Riebler_Plessl_2016, title={Opportunities for
    deferring application partitioning and accelerator synthesis to runtime (extended
    abstract)}, booktitle={Workshop on Reconfigurable Computing (WRC)}, author={Kenter,
    Tobias and Vaz, Gavin Francis and Riebler, Heinrich and Plessl, Christian}, year={2016}
    }'
  chicago: Kenter, Tobias, Gavin Francis Vaz, Heinrich Riebler, and Christian Plessl.
    “Opportunities for Deferring Application Partitioning and Accelerator Synthesis
    to Runtime (Extended Abstract).” In <i>Workshop on Reconfigurable Computing (WRC)</i>,
    2016.
  ieee: T. Kenter, G. F. Vaz, H. Riebler, and C. Plessl, “Opportunities for deferring
    application partitioning and accelerator synthesis to runtime (extended abstract),”
    2016.
  mla: Kenter, Tobias, et al. “Opportunities for Deferring Application Partitioning
    and Accelerator Synthesis to Runtime (Extended Abstract).” <i>Workshop on Reconfigurable
    Computing (WRC)</i>, 2016.
  short: 'T. Kenter, G.F. Vaz, H. Riebler, C. Plessl, in: Workshop on Reconfigurable
    Computing (WRC), 2016.'
date_created: 2017-10-17T12:41:25Z
date_updated: 2023-09-26T13:27:21Z
ddc:
- '040'
department:
- _id: '27'
- _id: '518'
file:
- access_level: closed
  content_type: application/pdf
  creator: florida
  date_created: 2018-03-21T12:39:46Z
  date_updated: 2018-03-21T12:39:46Z
  file_id: '1538'
  file_name: 171-plessl16_fpl_wrc.pdf
  file_size: 54421
  relation: main_file
  success: 1
file_date_updated: 2018-03-21T12:39:46Z
has_accepted_license: '1'
language:
- iso: eng
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: Workshop on Reconfigurable Computing (WRC)
quality_controlled: '1'
status: public
title: Opportunities for deferring application partitioning and accelerator synthesis
  to runtime (extended abstract)
type: conference
user_id: '15278'
year: '2016'
...
---
_id: '10024'
abstract:
- lang: eng
  text: The influence of electronic many-body interactions, spin-orbit coupling, and
    thermal lattice vibrations on the electronic structure of lithium niobate is calculated
    from first principles. Self-energy calculations in the GW approximation show that
    the inclusion of self-consistency in the Green function G and the screened Coulomb
    potential W opens the band gap far stronger than found in previous G0W0 calculations
    but slightly overestimates its actual value due to the neglect of excitonic effects
    in W. A realistic frozen-lattice band gap of about 5.9 eV is obtained by combining
    hybrid density functional theory with the QSGW0 scheme. The renormalization of
    the band gap due to electron-phonon coupling, derived here using molecular dynamics
    as well as density functional perturbation theory, reduces this value by about
    0.5 eV at room temperature. Spin-orbit coupling does not noticeably modify the
    fundamental gap but gives rise to a Rashba-like spin texture in the conduction
    band.
article_number: '075205'
article_type: original
author:
- first_name: Arthur
  full_name: Riefer, Arthur
  last_name: Riefer
- first_name: Michael
  full_name: Friedrich, Michael
  last_name: Friedrich
- first_name: Simone
  full_name: Sanna, Simone
  last_name: Sanna
- first_name: Uwe
  full_name: Gerstmann, Uwe
  id: '171'
  last_name: Gerstmann
  orcid: 0000-0002-4476-223X
- first_name: Arno
  full_name: Schindlmayr, Arno
  id: '458'
  last_name: Schindlmayr
  orcid: 0000-0002-4855-071X
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: 'Riefer A, Friedrich M, Sanna S, Gerstmann U, Schindlmayr A, Schmidt WG. LiNbO3
    electronic structure: Many-body interactions, spin-orbit coupling, and thermal
    effects. <i>Physical Review B</i>. 2016;93(7). doi:<a href="https://doi.org/10.1103/PhysRevB.93.075205">10.1103/PhysRevB.93.075205</a>'
  apa: 'Riefer, A., Friedrich, M., Sanna, S., Gerstmann, U., Schindlmayr, A., &#38;
    Schmidt, W. G. (2016). LiNbO3 electronic structure: Many-body interactions, spin-orbit
    coupling, and thermal effects. <i>Physical Review B</i>, <i>93</i>(7), Article
    075205. <a href="https://doi.org/10.1103/PhysRevB.93.075205">https://doi.org/10.1103/PhysRevB.93.075205</a>'
  bibtex: '@article{Riefer_Friedrich_Sanna_Gerstmann_Schindlmayr_Schmidt_2016, title={LiNbO3
    electronic structure: Many-body interactions, spin-orbit coupling, and thermal
    effects}, volume={93}, DOI={<a href="https://doi.org/10.1103/PhysRevB.93.075205">10.1103/PhysRevB.93.075205</a>},
    number={7075205}, journal={Physical Review B}, publisher={American Physical Society},
    author={Riefer, Arthur and Friedrich, Michael and Sanna, Simone and Gerstmann,
    Uwe and Schindlmayr, Arno and Schmidt, Wolf Gero}, year={2016} }'
  chicago: 'Riefer, Arthur, Michael Friedrich, Simone Sanna, Uwe Gerstmann, Arno Schindlmayr,
    and Wolf Gero Schmidt. “LiNbO3 Electronic Structure: Many-Body Interactions, Spin-Orbit
    Coupling, and Thermal Effects.” <i>Physical Review B</i> 93, no. 7 (2016). <a
    href="https://doi.org/10.1103/PhysRevB.93.075205">https://doi.org/10.1103/PhysRevB.93.075205</a>.'
  ieee: 'A. Riefer, M. Friedrich, S. Sanna, U. Gerstmann, A. Schindlmayr, and W. G.
    Schmidt, “LiNbO3 electronic structure: Many-body interactions, spin-orbit coupling,
    and thermal effects,” <i>Physical Review B</i>, vol. 93, no. 7, Art. no. 075205,
    2016, doi: <a href="https://doi.org/10.1103/PhysRevB.93.075205">10.1103/PhysRevB.93.075205</a>.'
  mla: 'Riefer, Arthur, et al. “LiNbO3 Electronic Structure: Many-Body Interactions,
    Spin-Orbit Coupling, and Thermal Effects.” <i>Physical Review B</i>, vol. 93,
    no. 7, 075205, American Physical Society, 2016, doi:<a href="https://doi.org/10.1103/PhysRevB.93.075205">10.1103/PhysRevB.93.075205</a>.'
  short: A. Riefer, M. Friedrich, S. Sanna, U. Gerstmann, A. Schindlmayr, W.G. Schmidt,
    Physical Review B 93 (2016).
date_created: 2019-05-29T07:50:59Z
date_updated: 2025-12-05T09:59:57Z
ddc:
- '530'
department:
- _id: '295'
- _id: '296'
- _id: '230'
- _id: '429'
- _id: '790'
- _id: '15'
- _id: '35'
- _id: '27'
doi: 10.1103/PhysRevB.93.075205
external_id:
  isi:
  - '000370794800004'
file:
- access_level: open_access
  content_type: application/pdf
  creator: schindlm
  date_created: 2020-08-27T20:36:43Z
  date_updated: 2020-08-30T14:39:23Z
  description: © 2016 American Physical Society
  file_id: '18469'
  file_name: PhysRevB.93.075205.pdf
  file_size: 1314637
  relation: main_file
  title: 'LiNbO3 electronic structure: Many-body interactions, spin-orbit coupling,
    and thermal effects'
file_date_updated: 2020-08-30T14:39:23Z
has_accepted_license: '1'
intvolume: '        93'
isi: '1'
issue: '7'
language:
- iso: eng
oa: '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: Physical Review B
publication_identifier:
  eissn:
  - 2469-9969
  issn:
  - 2469-9950
publication_status: published
publisher: American Physical Society
quality_controlled: '1'
status: public
title: 'LiNbO3 electronic structure: Many-body interactions, spin-orbit coupling,
  and thermal effects'
type: journal_article
user_id: '16199'
volume: 93
year: '2016'
...
---
_id: '10025'
abstract:
- lang: eng
  text: The phonon dispersions of the ferro‐ and paraelectric phase of LiTaO3 are
    calculated within density‐functional perturbation theory. The longitudinal optical
    phonon modes are theoretically derived and compared with available experimental
    data. Our results confirm the recent phonon assignment proposed by Margueron et
    al. [J. Appl. Phys. 111, 104105 (2012)] on the basis of spectroscopical studies.
    A comparison with the phonon band structure of the related material LiNbO3 shows
    minor differences that can be traced to the atomic‐mass difference between Ta
    and Nb. The presence of phonons with imaginary frequencies for the paraelectric
    phase suggests that it does not correspond to a minimum energy structure, and
    is compatible with an order‐disorder type phase transition.
article_type: original
author:
- first_name: Michael
  full_name: Friedrich, Michael
  last_name: Friedrich
- first_name: Arno
  full_name: Schindlmayr, Arno
  id: '458'
  last_name: Schindlmayr
  orcid: 0000-0002-4855-071X
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: Simone
  full_name: Sanna, Simone
  last_name: Sanna
citation:
  ama: Friedrich M, Schindlmayr A, Schmidt WG, Sanna S. LiTaO3 phonon dispersion and
    ferroelectric transition calculated from first principles. <i>Physica Status Solidi
    B</i>. 2016;253(4):683-689. doi:<a href="https://doi.org/10.1002/pssb.201552576">10.1002/pssb.201552576</a>
  apa: Friedrich, M., Schindlmayr, A., Schmidt, W. G., &#38; Sanna, S. (2016). LiTaO3
    phonon dispersion and ferroelectric transition calculated from first principles.
    <i>Physica Status Solidi B</i>, <i>253</i>(4), 683–689. <a href="https://doi.org/10.1002/pssb.201552576">https://doi.org/10.1002/pssb.201552576</a>
  bibtex: '@article{Friedrich_Schindlmayr_Schmidt_Sanna_2016, title={LiTaO3 phonon
    dispersion and ferroelectric transition calculated from first principles}, volume={253},
    DOI={<a href="https://doi.org/10.1002/pssb.201552576">10.1002/pssb.201552576</a>},
    number={4}, journal={Physica Status Solidi B}, publisher={Wiley-VCH}, author={Friedrich,
    Michael and Schindlmayr, Arno and Schmidt, Wolf Gero and Sanna, Simone}, year={2016},
    pages={683–689} }'
  chicago: 'Friedrich, Michael, Arno Schindlmayr, Wolf Gero Schmidt, and Simone Sanna.
    “LiTaO3 Phonon Dispersion and Ferroelectric Transition Calculated from First Principles.”
    <i>Physica Status Solidi B</i> 253, no. 4 (2016): 683–89. <a href="https://doi.org/10.1002/pssb.201552576">https://doi.org/10.1002/pssb.201552576</a>.'
  ieee: 'M. Friedrich, A. Schindlmayr, W. G. Schmidt, and S. Sanna, “LiTaO3 phonon
    dispersion and ferroelectric transition calculated from first principles,” <i>Physica
    Status Solidi B</i>, vol. 253, no. 4, pp. 683–689, 2016, doi: <a href="https://doi.org/10.1002/pssb.201552576">10.1002/pssb.201552576</a>.'
  mla: Friedrich, Michael, et al. “LiTaO3 Phonon Dispersion and Ferroelectric Transition
    Calculated from First Principles.” <i>Physica Status Solidi B</i>, vol. 253, no.
    4, Wiley-VCH, 2016, pp. 683–89, doi:<a href="https://doi.org/10.1002/pssb.201552576">10.1002/pssb.201552576</a>.
  short: M. Friedrich, A. Schindlmayr, W.G. Schmidt, S. Sanna, Physica Status Solidi
    B 253 (2016) 683–689.
date_created: 2019-05-29T07:52:52Z
date_updated: 2025-12-05T09:58:55Z
ddc:
- '530'
department:
- _id: '295'
- _id: '296'
- _id: '230'
- _id: '429'
- _id: '15'
- _id: '35'
- _id: '27'
doi: 10.1002/pssb.201552576
external_id:
  isi:
  - '000374142500015'
file:
- access_level: closed
  content_type: application/pdf
  creator: schindlm
  date_created: 2020-08-28T14:22:11Z
  date_updated: 2020-08-30T14:41:39Z
  description: © 2015 WILEY‐VCH Verlag GmbH & Co. KGaA, Weinheim
  file_id: '18577'
  file_name: pssb.201552576.pdf
  file_size: 402594
  relation: main_file
  title: LiTaO3 phonon dispersion and ferroelectric transition calculated from first
    principles
file_date_updated: 2020-08-30T14:41:39Z
has_accepted_license: '1'
intvolume: '       253'
isi: '1'
issue: '4'
language:
- iso: eng
page: 683-689
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: Physica Status Solidi B
publication_identifier:
  eissn:
  - 1521-3951
  issn:
  - 0370-1972
publication_status: published
publisher: Wiley-VCH
quality_controlled: '1'
status: public
title: LiTaO3 phonon dispersion and ferroelectric transition calculated from first
  principles
type: journal_article
user_id: '16199'
volume: 253
year: '2016'
...
---
_id: '13492'
article_number: '025704'
author:
- first_name: Stefano
  full_name: Tebi, Stefano
  last_name: Tebi
- first_name: Hazem
  full_name: Aldahhak, Hazem
  last_name: Aldahhak
- first_name: Giulia
  full_name: Serrano, Giulia
  last_name: Serrano
- first_name: Wolfgang
  full_name: Schöfberger, Wolfgang
  last_name: Schöfberger
- first_name: Eva
  full_name: Rauls, Eva
  last_name: Rauls
- 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
- first_name: Stefan
  full_name: Müllegger, Stefan
  last_name: Müllegger
citation:
  ama: Tebi S, Aldahhak H, Serrano G, et al. Manipulation resolves non-trivial structure
    of corrole monolayer on Ag(111). <i>Nanotechnology</i>. 2016;27. doi:<a href="https://doi.org/10.1088/0957-4484/27/2/025704">10.1088/0957-4484/27/2/025704</a>
  apa: Tebi, S., Aldahhak, H., Serrano, G., Schöfberger, W., Rauls, E., Schmidt, W.
    G., Koch, R., &#38; Müllegger, S. (2016). Manipulation resolves non-trivial structure
    of corrole monolayer on Ag(111). <i>Nanotechnology</i>, <i>27</i>, Article 025704.
    <a href="https://doi.org/10.1088/0957-4484/27/2/025704">https://doi.org/10.1088/0957-4484/27/2/025704</a>
  bibtex: '@article{Tebi_Aldahhak_Serrano_Schöfberger_Rauls_Schmidt_Koch_Müllegger_2016,
    title={Manipulation resolves non-trivial structure of corrole monolayer on Ag(111)},
    volume={27}, DOI={<a href="https://doi.org/10.1088/0957-4484/27/2/025704">10.1088/0957-4484/27/2/025704</a>},
    number={025704}, journal={Nanotechnology}, author={Tebi, Stefano and Aldahhak,
    Hazem and Serrano, Giulia and Schöfberger, Wolfgang and Rauls, Eva and Schmidt,
    Wolf Gero and Koch, Reinhold and Müllegger, Stefan}, year={2016} }'
  chicago: Tebi, Stefano, Hazem Aldahhak, Giulia Serrano, Wolfgang Schöfberger, Eva
    Rauls, Wolf Gero Schmidt, Reinhold Koch, and Stefan Müllegger. “Manipulation Resolves
    Non-Trivial Structure of Corrole Monolayer on Ag(111).” <i>Nanotechnology</i>
    27 (2016). <a href="https://doi.org/10.1088/0957-4484/27/2/025704">https://doi.org/10.1088/0957-4484/27/2/025704</a>.
  ieee: 'S. Tebi <i>et al.</i>, “Manipulation resolves non-trivial structure of corrole
    monolayer on Ag(111),” <i>Nanotechnology</i>, vol. 27, Art. no. 025704, 2016,
    doi: <a href="https://doi.org/10.1088/0957-4484/27/2/025704">10.1088/0957-4484/27/2/025704</a>.'
  mla: Tebi, Stefano, et al. “Manipulation Resolves Non-Trivial Structure of Corrole
    Monolayer on Ag(111).” <i>Nanotechnology</i>, vol. 27, 025704, 2016, doi:<a href="https://doi.org/10.1088/0957-4484/27/2/025704">10.1088/0957-4484/27/2/025704</a>.
  short: S. Tebi, H. Aldahhak, G. Serrano, W. Schöfberger, E. Rauls, W.G. Schmidt,
    R. Koch, S. Müllegger, Nanotechnology 27 (2016).
date_created: 2019-09-30T12:29:16Z
date_updated: 2025-12-05T10:20:57Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1088/0957-4484/27/2/025704
funded_apc: '1'
intvolume: '        27'
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Nanotechnology
publication_identifier:
  issn:
  - 0957-4484
  - 1361-6528
publication_status: published
status: public
title: Manipulation resolves non-trivial structure of corrole monolayer on Ag(111)
type: journal_article
user_id: '16199'
volume: 27
year: '2016'
...
---
_id: '13476'
author:
- first_name: Nora Jenny
  full_name: Vollmers, Nora Jenny
  last_name: Vollmers
- first_name: Patrick
  full_name: Müller, Patrick
  last_name: Müller
- first_name: Alexander
  full_name: Hoffmann, Alexander
  last_name: Hoffmann
- first_name: Sonja
  full_name: Herres-Pawlis, Sonja
  last_name: Herres-Pawlis
- first_name: Martin
  full_name: Rohrmüller, Martin
  last_name: Rohrmüller
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: Uwe
  full_name: Gerstmann, Uwe
  id: '171'
  last_name: Gerstmann
  orcid: 0000-0002-4476-223X
- first_name: Matthias
  full_name: Bauer, Matthias
  id: '47241'
  last_name: Bauer
  orcid: 0000-0002-9294-6076
citation:
  ama: 'Vollmers NJ, Müller P, Hoffmann A, et al. Experimental and Theoretical High-Energy-Resolution
    X-ray Absorption Spectroscopy: Implications for the Investigation of the Entatic
    State. <i>Inorganic Chemistry</i>. 2016;55:11694-11706. doi:<a href="https://doi.org/10.1021/acs.inorgchem.6b01704">10.1021/acs.inorgchem.6b01704</a>'
  apa: 'Vollmers, N. J., Müller, P., Hoffmann, A., Herres-Pawlis, S., Rohrmüller,
    M., Schmidt, W. G., Gerstmann, U., &#38; Bauer, M. (2016). Experimental and Theoretical
    High-Energy-Resolution X-ray Absorption Spectroscopy: Implications for the Investigation
    of the Entatic State. <i>Inorganic Chemistry</i>, <i>55</i>, 11694–11706. <a href="https://doi.org/10.1021/acs.inorgchem.6b01704">https://doi.org/10.1021/acs.inorgchem.6b01704</a>'
  bibtex: '@article{Vollmers_Müller_Hoffmann_Herres-Pawlis_Rohrmüller_Schmidt_Gerstmann_Bauer_2016,
    title={Experimental and Theoretical High-Energy-Resolution X-ray Absorption Spectroscopy:
    Implications for the Investigation of the Entatic State}, volume={55}, DOI={<a
    href="https://doi.org/10.1021/acs.inorgchem.6b01704">10.1021/acs.inorgchem.6b01704</a>},
    journal={Inorganic Chemistry}, author={Vollmers, Nora Jenny and Müller, Patrick
    and Hoffmann, Alexander and Herres-Pawlis, Sonja and Rohrmüller, Martin and Schmidt,
    Wolf Gero and Gerstmann, Uwe and Bauer, Matthias}, year={2016}, pages={11694–11706}
    }'
  chicago: 'Vollmers, Nora Jenny, Patrick Müller, Alexander Hoffmann, Sonja Herres-Pawlis,
    Martin Rohrmüller, Wolf Gero Schmidt, Uwe Gerstmann, and Matthias Bauer. “Experimental
    and Theoretical High-Energy-Resolution X-Ray Absorption Spectroscopy: Implications
    for the Investigation of the Entatic State.” <i>Inorganic Chemistry</i> 55 (2016):
    11694–706. <a href="https://doi.org/10.1021/acs.inorgchem.6b01704">https://doi.org/10.1021/acs.inorgchem.6b01704</a>.'
  ieee: 'N. J. Vollmers <i>et al.</i>, “Experimental and Theoretical High-Energy-Resolution
    X-ray Absorption Spectroscopy: Implications for the Investigation of the Entatic
    State,” <i>Inorganic Chemistry</i>, vol. 55, pp. 11694–11706, 2016, doi: <a href="https://doi.org/10.1021/acs.inorgchem.6b01704">10.1021/acs.inorgchem.6b01704</a>.'
  mla: 'Vollmers, Nora Jenny, et al. “Experimental and Theoretical High-Energy-Resolution
    X-Ray Absorption Spectroscopy: Implications for the Investigation of the Entatic
    State.” <i>Inorganic Chemistry</i>, vol. 55, 2016, pp. 11694–706, doi:<a href="https://doi.org/10.1021/acs.inorgchem.6b01704">10.1021/acs.inorgchem.6b01704</a>.'
  short: N.J. Vollmers, P. Müller, A. Hoffmann, S. Herres-Pawlis, M. Rohrmüller, W.G.
    Schmidt, U. Gerstmann, M. Bauer, Inorganic Chemistry 55 (2016) 11694–11706.
date_created: 2019-09-30T11:31:03Z
date_updated: 2025-12-05T10:26:19Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '2'
- _id: '306'
- _id: '230'
- _id: '27'
doi: 10.1021/acs.inorgchem.6b01704
intvolume: '        55'
language:
- iso: eng
page: 11694-11706
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Inorganic Chemistry
publication_identifier:
  issn:
  - 0020-1669
  - 1520-510X
publication_status: published
status: public
title: 'Experimental and Theoretical High-Energy-Resolution X-ray Absorption Spectroscopy:
  Implications for the Investigation of the Entatic State'
type: journal_article
user_id: '16199'
volume: 55
year: '2016'
...
---
_id: '13477'
author:
- first_name: Matthias
  full_name: Witte, Matthias
  last_name: Witte
- first_name: Benjamin
  full_name: Grimm-Lebsanft, Benjamin
  last_name: Grimm-Lebsanft
- first_name: Arne
  full_name: Goos, Arne
  last_name: Goos
- first_name: Stephan
  full_name: Binder, Stephan
  last_name: Binder
- first_name: Michael
  full_name: Rübhausen, Michael
  last_name: Rübhausen
- first_name: Martin
  full_name: Bernard, Martin
  last_name: Bernard
- first_name: Adam
  full_name: Neuba, Adam
  last_name: Neuba
- first_name: Serge
  full_name: Gorelsky, Serge
  last_name: Gorelsky
- first_name: Uwe
  full_name: Gerstmann, Uwe
  id: '171'
  last_name: Gerstmann
  orcid: 0000-0002-4476-223X
- first_name: Gerald
  full_name: Henkel, Gerald
  last_name: Henkel
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: Sonja
  full_name: Herres-Pawlis, Sonja
  last_name: Herres-Pawlis
citation:
  ama: Witte M, Grimm-Lebsanft B, Goos A, et al. Optical response of the Cu2S2diamond
    core in Cu2II(NGuaS)2Cl2. <i>Journal of Computational Chemistry</i>. 2016;37(23-24):2181-2192.
    doi:<a href="https://doi.org/10.1002/jcc.24439">10.1002/jcc.24439</a>
  apa: Witte, M., Grimm-Lebsanft, B., Goos, A., Binder, S., Rübhausen, M., Bernard,
    M., Neuba, A., Gorelsky, S., Gerstmann, U., Henkel, G., Schmidt, W. G., &#38;
    Herres-Pawlis, S. (2016). Optical response of the Cu2S2diamond core in Cu2II(NGuaS)2Cl2.
    <i>Journal of Computational Chemistry</i>, <i>37</i>(23–24), 2181–2192. <a href="https://doi.org/10.1002/jcc.24439">https://doi.org/10.1002/jcc.24439</a>
  bibtex: '@article{Witte_Grimm-Lebsanft_Goos_Binder_Rübhausen_Bernard_Neuba_Gorelsky_Gerstmann_Henkel_et
    al._2016, title={Optical response of the Cu2S2diamond core in Cu2II(NGuaS)2Cl2},
    volume={37}, DOI={<a href="https://doi.org/10.1002/jcc.24439">10.1002/jcc.24439</a>},
    number={23–24}, journal={Journal of Computational Chemistry}, author={Witte, Matthias
    and Grimm-Lebsanft, Benjamin and Goos, Arne and Binder, Stephan and Rübhausen,
    Michael and Bernard, Martin and Neuba, Adam and Gorelsky, Serge and Gerstmann,
    Uwe and Henkel, Gerald and et al.}, year={2016}, pages={2181–2192} }'
  chicago: 'Witte, Matthias, Benjamin Grimm-Lebsanft, Arne Goos, Stephan Binder, Michael
    Rübhausen, Martin Bernard, Adam Neuba, et al. “Optical Response of the Cu2S2diamond
    Core in Cu2II(NGuaS)2Cl2.” <i>Journal of Computational Chemistry</i> 37, no. 23–24
    (2016): 2181–92. <a href="https://doi.org/10.1002/jcc.24439">https://doi.org/10.1002/jcc.24439</a>.'
  ieee: 'M. Witte <i>et al.</i>, “Optical response of the Cu2S2diamond core in Cu2II(NGuaS)2Cl2,”
    <i>Journal of Computational Chemistry</i>, vol. 37, no. 23–24, pp. 2181–2192,
    2016, doi: <a href="https://doi.org/10.1002/jcc.24439">10.1002/jcc.24439</a>.'
  mla: Witte, Matthias, et al. “Optical Response of the Cu2S2diamond Core in Cu2II(NGuaS)2Cl2.”
    <i>Journal of Computational Chemistry</i>, vol. 37, no. 23–24, 2016, pp. 2181–92,
    doi:<a href="https://doi.org/10.1002/jcc.24439">10.1002/jcc.24439</a>.
  short: M. Witte, B. Grimm-Lebsanft, A. Goos, S. Binder, M. Rübhausen, M. Bernard,
    A. Neuba, S. Gorelsky, U. Gerstmann, G. Henkel, W.G. Schmidt, S. Herres-Pawlis,
    Journal of Computational Chemistry 37 (2016) 2181–2192.
date_created: 2019-09-30T11:34:50Z
date_updated: 2025-12-05T10:25:31Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '2'
- _id: '305'
- _id: '230'
- _id: '27'
doi: 10.1002/jcc.24439
intvolume: '        37'
issue: 23-24
language:
- iso: eng
page: 2181-2192
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: Optical response of the Cu2S2diamond core in Cu2II(NGuaS)2Cl2
type: journal_article
user_id: '16199'
volume: 37
year: '2016'
...
---
_id: '13479'
author:
- first_name: Andreas
  full_name: Lücke, Andreas
  last_name: Lücke
- first_name: Frank
  full_name: Ortmann, Frank
  last_name: Ortmann
- first_name: Michel
  full_name: Panhans, Michel
  last_name: Panhans
- first_name: Simone
  full_name: Sanna, Simone
  last_name: Sanna
- 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: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: Lücke A, Ortmann F, Panhans M, et al. Temperature-Dependent Hole Mobility and
    Its Limit in Crystal-Phase P3HT Calculated from First Principles. <i>The Journal
    of Physical Chemistry B</i>. 2016;120:5572-5580. doi:<a href="https://doi.org/10.1021/acs.jpcb.6b03598">10.1021/acs.jpcb.6b03598</a>
  apa: Lücke, A., Ortmann, F., Panhans, M., Sanna, S., Rauls, E., Gerstmann, U., &#38;
    Schmidt, W. G. (2016). Temperature-Dependent Hole Mobility and Its Limit in Crystal-Phase
    P3HT Calculated from First Principles. <i>The Journal of Physical Chemistry B</i>,
    <i>120</i>, 5572–5580. <a href="https://doi.org/10.1021/acs.jpcb.6b03598">https://doi.org/10.1021/acs.jpcb.6b03598</a>
  bibtex: '@article{Lücke_Ortmann_Panhans_Sanna_Rauls_Gerstmann_Schmidt_2016, title={Temperature-Dependent
    Hole Mobility and Its Limit in Crystal-Phase P3HT Calculated from First Principles},
    volume={120}, DOI={<a href="https://doi.org/10.1021/acs.jpcb.6b03598">10.1021/acs.jpcb.6b03598</a>},
    journal={The Journal of Physical Chemistry B}, author={Lücke, Andreas and Ortmann,
    Frank and Panhans, Michel and Sanna, Simone and Rauls, Eva and Gerstmann, Uwe
    and Schmidt, Wolf Gero}, year={2016}, pages={5572–5580} }'
  chicago: 'Lücke, Andreas, Frank Ortmann, Michel Panhans, Simone Sanna, Eva Rauls,
    Uwe Gerstmann, and Wolf Gero Schmidt. “Temperature-Dependent Hole Mobility and
    Its Limit in Crystal-Phase P3HT Calculated from First Principles.” <i>The Journal
    of Physical Chemistry B</i> 120 (2016): 5572–80. <a href="https://doi.org/10.1021/acs.jpcb.6b03598">https://doi.org/10.1021/acs.jpcb.6b03598</a>.'
  ieee: 'A. Lücke <i>et al.</i>, “Temperature-Dependent Hole Mobility and Its Limit
    in Crystal-Phase P3HT Calculated from First Principles,” <i>The Journal of Physical
    Chemistry B</i>, vol. 120, pp. 5572–5580, 2016, doi: <a href="https://doi.org/10.1021/acs.jpcb.6b03598">10.1021/acs.jpcb.6b03598</a>.'
  mla: Lücke, Andreas, et al. “Temperature-Dependent Hole Mobility and Its Limit in
    Crystal-Phase P3HT Calculated from First Principles.” <i>The Journal of Physical
    Chemistry B</i>, vol. 120, 2016, pp. 5572–80, doi:<a href="https://doi.org/10.1021/acs.jpcb.6b03598">10.1021/acs.jpcb.6b03598</a>.
  short: A. Lücke, F. Ortmann, M. Panhans, S. Sanna, E. Rauls, U. Gerstmann, W.G.
    Schmidt, The Journal of Physical Chemistry B 120 (2016) 5572–5580.
date_created: 2019-09-30T11:42:37Z
date_updated: 2025-12-05T10:24:31Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '790'
- _id: '27'
doi: 10.1021/acs.jpcb.6b03598
intvolume: '       120'
language:
- iso: eng
page: 5572-5580
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: Temperature-Dependent Hole Mobility and Its Limit in Crystal-Phase P3HT Calculated
  from First Principles
type: journal_article
user_id: '16199'
volume: 120
year: '2016'
...
---
_id: '13480'
author:
- first_name: A.
  full_name: Paulheim, A.
  last_name: Paulheim
- first_name: C.
  full_name: Marquardt, C.
  last_name: Marquardt
- first_name: Hazem
  full_name: Aldahhak, Hazem
  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
- first_name: M.
  full_name: Sokolowski, M.
  last_name: Sokolowski
citation:
  ama: Paulheim A, Marquardt C, Aldahhak H, Rauls E, Schmidt WG, Sokolowski M. Inhomogeneous
    and Homogeneous Line Broadening of Optical Spectra of PTCDA Molecules Adsorbed
    at Step Edges of Alkali Halide Surfaces. <i>The Journal of Physical Chemistry
    C</i>. 2016;10:11926-11937. doi:<a href="https://doi.org/10.1021/acs.jpcc.6b01956">10.1021/acs.jpcc.6b01956</a>
  apa: Paulheim, A., Marquardt, C., Aldahhak, H., Rauls, E., Schmidt, W. G., &#38;
    Sokolowski, M. (2016). Inhomogeneous and Homogeneous Line Broadening of Optical
    Spectra of PTCDA Molecules Adsorbed at Step Edges of Alkali Halide Surfaces. <i>The
    Journal of Physical Chemistry C</i>, <i>10</i>, 11926–11937. <a href="https://doi.org/10.1021/acs.jpcc.6b01956">https://doi.org/10.1021/acs.jpcc.6b01956</a>
  bibtex: '@article{Paulheim_Marquardt_Aldahhak_Rauls_Schmidt_Sokolowski_2016, title={Inhomogeneous
    and Homogeneous Line Broadening of Optical Spectra of PTCDA Molecules Adsorbed
    at Step Edges of Alkali Halide Surfaces}, volume={10}, DOI={<a href="https://doi.org/10.1021/acs.jpcc.6b01956">10.1021/acs.jpcc.6b01956</a>},
    journal={The Journal of Physical Chemistry C}, author={Paulheim, A. and Marquardt,
    C. and Aldahhak, Hazem and Rauls, E. and Schmidt, Wolf Gero and Sokolowski, M.},
    year={2016}, pages={11926–11937} }'
  chicago: 'Paulheim, A., C. Marquardt, Hazem Aldahhak, E. Rauls, Wolf Gero Schmidt,
    and M. Sokolowski. “Inhomogeneous and Homogeneous Line Broadening of Optical Spectra
    of PTCDA Molecules Adsorbed at Step Edges of Alkali Halide Surfaces.” <i>The Journal
    of Physical Chemistry C</i> 10 (2016): 11926–37. <a href="https://doi.org/10.1021/acs.jpcc.6b01956">https://doi.org/10.1021/acs.jpcc.6b01956</a>.'
  ieee: 'A. Paulheim, C. Marquardt, H. Aldahhak, E. Rauls, W. G. Schmidt, and M. Sokolowski,
    “Inhomogeneous and Homogeneous Line Broadening of Optical Spectra of PTCDA Molecules
    Adsorbed at Step Edges of Alkali Halide Surfaces,” <i>The Journal of Physical
    Chemistry C</i>, vol. 10, pp. 11926–11937, 2016, doi: <a href="https://doi.org/10.1021/acs.jpcc.6b01956">10.1021/acs.jpcc.6b01956</a>.'
  mla: Paulheim, A., et al. “Inhomogeneous and Homogeneous Line Broadening of Optical
    Spectra of PTCDA Molecules Adsorbed at Step Edges of Alkali Halide Surfaces.”
    <i>The Journal of Physical Chemistry C</i>, vol. 10, 2016, pp. 11926–37, doi:<a
    href="https://doi.org/10.1021/acs.jpcc.6b01956">10.1021/acs.jpcc.6b01956</a>.
  short: A. Paulheim, C. Marquardt, H. Aldahhak, E. Rauls, W.G. Schmidt, M. Sokolowski,
    The Journal of Physical Chemistry C 10 (2016) 11926–11937.
date_created: 2019-09-30T11:48:22Z
date_updated: 2025-12-05T10:24:01Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1021/acs.jpcc.6b01956
intvolume: '        10'
language:
- iso: eng
page: 11926-11937
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: Inhomogeneous and Homogeneous Line Broadening of Optical Spectra of PTCDA Molecules
  Adsorbed at Step Edges of Alkali Halide Surfaces
type: journal_article
user_id: '16199'
volume: 10
year: '2016'
...
---
_id: '13485'
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
- first_name: F.
  full_name: Timmer, F.
  last_name: Timmer
- first_name: J.
  full_name: Wollschläger, J.
  last_name: Wollschläger
- first_name: M.
  full_name: Franz, M.
  last_name: Franz
- first_name: S.
  full_name: Appelfeller, S.
  last_name: Appelfeller
- first_name: M.
  full_name: Dähne, M.
  last_name: Dähne
citation:
  ama: Sanna S, Dues C, Schmidt WG, et al. Rare-earth silicide thin films on the Si(111)
    surface. <i>Physical Review B</i>. 2016;93(19). doi:<a href="https://doi.org/10.1103/physrevb.93.195407">10.1103/physrevb.93.195407</a>
  apa: Sanna, S., Dues, C., Schmidt, W. G., Timmer, F., Wollschläger, J., Franz, M.,
    Appelfeller, S., &#38; Dähne, M. (2016). Rare-earth silicide thin films on the
    Si(111) surface. <i>Physical Review B</i>, <i>93</i>(19). <a href="https://doi.org/10.1103/physrevb.93.195407">https://doi.org/10.1103/physrevb.93.195407</a>
  bibtex: '@article{Sanna_Dues_Schmidt_Timmer_Wollschläger_Franz_Appelfeller_Dähne_2016,
    title={Rare-earth silicide thin films on the Si(111) surface}, volume={93}, DOI={<a
    href="https://doi.org/10.1103/physrevb.93.195407">10.1103/physrevb.93.195407</a>},
    number={19}, journal={Physical Review B}, author={Sanna, S. and Dues, C. and Schmidt,
    Wolf Gero and Timmer, F. and Wollschläger, J. and Franz, M. and Appelfeller, S.
    and Dähne, M.}, year={2016} }'
  chicago: Sanna, S., C. Dues, Wolf Gero Schmidt, F. Timmer, J. Wollschläger, M. Franz,
    S. Appelfeller, and M. Dähne. “Rare-Earth Silicide Thin Films on the Si(111) Surface.”
    <i>Physical Review B</i> 93, no. 19 (2016). <a href="https://doi.org/10.1103/physrevb.93.195407">https://doi.org/10.1103/physrevb.93.195407</a>.
  ieee: 'S. Sanna <i>et al.</i>, “Rare-earth silicide thin films on the Si(111) surface,”
    <i>Physical Review B</i>, vol. 93, no. 19, 2016, doi: <a href="https://doi.org/10.1103/physrevb.93.195407">10.1103/physrevb.93.195407</a>.'
  mla: Sanna, S., et al. “Rare-Earth Silicide Thin Films on the Si(111) Surface.”
    <i>Physical Review B</i>, vol. 93, no. 19, 2016, doi:<a href="https://doi.org/10.1103/physrevb.93.195407">10.1103/physrevb.93.195407</a>.
  short: S. Sanna, C. Dues, W.G. Schmidt, F. Timmer, J. Wollschläger, M. Franz, S.
    Appelfeller, M. Dähne, Physical Review B 93 (2016).
date_created: 2019-09-30T12:10:50Z
date_updated: 2025-12-05T10:23:07Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1103/physrevb.93.195407
funded_apc: '1'
intvolume: '        93'
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:
  - 2469-9950
  - 2469-9969
publication_status: published
status: public
title: Rare-earth silicide thin films on the Si(111) surface
type: journal_article
user_id: '16199'
volume: 93
year: '2016'
...
---
_id: '13487'
author:
- first_name: M.
  full_name: Witte, M.
  last_name: Witte
- first_name: Uwe
  full_name: Gerstmann, Uwe
  id: '171'
  last_name: Gerstmann
  orcid: 0000-0002-4476-223X
- first_name: Adam
  full_name: Neuba, Adam
  last_name: Neuba
- first_name: G.
  full_name: Henkel, G.
  last_name: Henkel
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: Witte M, Gerstmann U, Neuba A, Henkel G, Schmidt WG. Density functional theory
    of the CuA-like Cu2S2 diamond core in Cu 2II(NGuaS)2Cl2. <i>Journal of Computational
    Chemistry</i>. 2016;37:1005-1018. doi:<a href="https://doi.org/10.1002/jcc.24289">10.1002/jcc.24289</a>
  apa: Witte, M., Gerstmann, U., Neuba, A., Henkel, G., &#38; Schmidt, W. G. (2016).
    Density functional theory of the CuA-like Cu2S2 diamond core in Cu 2II(NGuaS)2Cl2.
    <i>Journal of Computational Chemistry</i>, <i>37</i>, 1005–1018. <a href="https://doi.org/10.1002/jcc.24289">https://doi.org/10.1002/jcc.24289</a>
  bibtex: '@article{Witte_Gerstmann_Neuba_Henkel_Schmidt_2016, title={Density functional
    theory of the CuA-like Cu2S2 diamond core in Cu 2II(NGuaS)2Cl2}, volume={37},
    DOI={<a href="https://doi.org/10.1002/jcc.24289">10.1002/jcc.24289</a>}, journal={Journal
    of Computational Chemistry}, author={Witte, M. and Gerstmann, Uwe and Neuba, Adam
    and Henkel, G. and Schmidt, Wolf Gero}, year={2016}, pages={1005–1018} }'
  chicago: 'Witte, M., Uwe Gerstmann, Adam Neuba, G. Henkel, and Wolf Gero Schmidt.
    “Density Functional Theory of the CuA-like Cu2S2 Diamond Core in Cu 2II(NGuaS)2Cl2.”
    <i>Journal of Computational Chemistry</i> 37 (2016): 1005–18. <a href="https://doi.org/10.1002/jcc.24289">https://doi.org/10.1002/jcc.24289</a>.'
  ieee: 'M. Witte, U. Gerstmann, A. Neuba, G. Henkel, and W. G. Schmidt, “Density
    functional theory of the CuA-like Cu2S2 diamond core in Cu 2II(NGuaS)2Cl2,” <i>Journal
    of Computational Chemistry</i>, vol. 37, pp. 1005–1018, 2016, doi: <a href="https://doi.org/10.1002/jcc.24289">10.1002/jcc.24289</a>.'
  mla: Witte, M., et al. “Density Functional Theory of the CuA-like Cu2S2 Diamond
    Core in Cu 2II(NGuaS)2Cl2.” <i>Journal of Computational Chemistry</i>, vol. 37,
    2016, pp. 1005–18, doi:<a href="https://doi.org/10.1002/jcc.24289">10.1002/jcc.24289</a>.
  short: M. Witte, U. Gerstmann, A. Neuba, G. Henkel, W.G. Schmidt, Journal of Computational
    Chemistry 37 (2016) 1005–1018.
date_created: 2019-09-30T12:17:57Z
date_updated: 2025-12-05T10:22:42Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '2'
- _id: '305'
- _id: '27'
- _id: '230'
doi: 10.1002/jcc.24289
intvolume: '        37'
language:
- iso: eng
page: 1005-1018
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: Density functional theory of the CuA-like Cu2S2 diamond core in Cu 2II(NGuaS)2Cl2
type: journal_article
user_id: '16199'
volume: 37
year: '2016'
...
---
_id: '13481'
author:
- first_name: Eric
  full_name: Jeckelmann, Eric
  last_name: Jeckelmann
- 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: Eugen
  full_name: Speiser, Eugen
  last_name: Speiser
- first_name: Norbert
  full_name: Esser, Norbert
  last_name: Esser
citation:
  ama: Jeckelmann E, Sanna S, Schmidt WG, Speiser E, Esser N. Grand canonical Peierls
    transition in In/Si(111). <i>Physical Review B</i>. 2016;93(24). doi:<a href="https://doi.org/10.1103/physrevb.93.241407">10.1103/physrevb.93.241407</a>
  apa: Jeckelmann, E., Sanna, S., Schmidt, W. G., Speiser, E., &#38; Esser, N. (2016).
    Grand canonical Peierls transition in In/Si(111). <i>Physical Review B</i>, <i>93</i>(24).
    <a href="https://doi.org/10.1103/physrevb.93.241407">https://doi.org/10.1103/physrevb.93.241407</a>
  bibtex: '@article{Jeckelmann_Sanna_Schmidt_Speiser_Esser_2016, title={Grand canonical
    Peierls transition in In/Si(111)}, volume={93}, DOI={<a href="https://doi.org/10.1103/physrevb.93.241407">10.1103/physrevb.93.241407</a>},
    number={24}, journal={Physical Review B}, author={Jeckelmann, Eric and Sanna,
    Simone and Schmidt, Wolf Gero and Speiser, Eugen and Esser, Norbert}, year={2016}
    }'
  chicago: Jeckelmann, Eric, Simone Sanna, Wolf Gero Schmidt, Eugen Speiser, and Norbert
    Esser. “Grand Canonical Peierls Transition in In/Si(111).” <i>Physical Review
    B</i> 93, no. 24 (2016). <a href="https://doi.org/10.1103/physrevb.93.241407">https://doi.org/10.1103/physrevb.93.241407</a>.
  ieee: 'E. Jeckelmann, S. Sanna, W. G. Schmidt, E. Speiser, and N. Esser, “Grand
    canonical Peierls transition in In/Si(111),” <i>Physical Review B</i>, vol. 93,
    no. 24, 2016, doi: <a href="https://doi.org/10.1103/physrevb.93.241407">10.1103/physrevb.93.241407</a>.'
  mla: Jeckelmann, Eric, et al. “Grand Canonical Peierls Transition in In/Si(111).”
    <i>Physical Review B</i>, vol. 93, no. 24, 2016, doi:<a href="https://doi.org/10.1103/physrevb.93.241407">10.1103/physrevb.93.241407</a>.
  short: E. Jeckelmann, S. Sanna, W.G. Schmidt, E. Speiser, N. Esser, Physical Review
    B 93 (2016).
date_created: 2019-09-30T11:51:43Z
date_updated: 2025-12-05T10:23:31Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1103/physrevb.93.241407
funded_apc: '1'
intvolume: '        93'
issue: '24'
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Physical Review B
publication_identifier:
  issn:
  - 2469-9950
  - 2469-9969
publication_status: published
status: public
title: Grand canonical Peierls transition in In/Si(111)
type: journal_article
user_id: '16199'
volume: 93
year: '2016'
...
---
_id: '13478'
author:
- first_name: E.
  full_name: Speiser, E.
  last_name: Speiser
- first_name: N.
  full_name: Esser, N.
  last_name: Esser
- first_name: S.
  full_name: Wippermann, S.
  last_name: Wippermann
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: Speiser E, Esser N, Wippermann S, Schmidt WG. Surface vibrational Raman modes
    of In:Si(111)(4×1)and(8×2)nanowires. <i>Physical Review B</i>. 2016;94(7). doi:<a
    href="https://doi.org/10.1103/physrevb.94.075417">10.1103/physrevb.94.075417</a>
  apa: Speiser, E., Esser, N., Wippermann, S., &#38; Schmidt, W. G. (2016). Surface
    vibrational Raman modes of In:Si(111)(4×1)and(8×2)nanowires. <i>Physical Review
    B</i>, <i>94</i>(7). <a href="https://doi.org/10.1103/physrevb.94.075417">https://doi.org/10.1103/physrevb.94.075417</a>
  bibtex: '@article{Speiser_Esser_Wippermann_Schmidt_2016, title={Surface vibrational
    Raman modes of In:Si(111)(4×1)and(8×2)nanowires}, volume={94}, DOI={<a href="https://doi.org/10.1103/physrevb.94.075417">10.1103/physrevb.94.075417</a>},
    number={7}, journal={Physical Review B}, author={Speiser, E. and Esser, N. and
    Wippermann, S. and Schmidt, Wolf Gero}, year={2016} }'
  chicago: Speiser, E., N. Esser, S. Wippermann, and Wolf Gero Schmidt. “Surface Vibrational
    Raman Modes of In:Si(111)(4×1)and(8×2)Nanowires.” <i>Physical Review B</i> 94,
    no. 7 (2016). <a href="https://doi.org/10.1103/physrevb.94.075417">https://doi.org/10.1103/physrevb.94.075417</a>.
  ieee: 'E. Speiser, N. Esser, S. Wippermann, and W. G. Schmidt, “Surface vibrational
    Raman modes of In:Si(111)(4×1)and(8×2)nanowires,” <i>Physical Review B</i>, vol.
    94, no. 7, 2016, doi: <a href="https://doi.org/10.1103/physrevb.94.075417">10.1103/physrevb.94.075417</a>.'
  mla: Speiser, E., et al. “Surface Vibrational Raman Modes of In:Si(111)(4×1)and(8×2)Nanowires.”
    <i>Physical Review B</i>, vol. 94, no. 7, 2016, doi:<a href="https://doi.org/10.1103/physrevb.94.075417">10.1103/physrevb.94.075417</a>.
  short: E. Speiser, N. Esser, S. Wippermann, W.G. Schmidt, Physical Review B 94 (2016).
date_created: 2019-09-30T11:36:41Z
date_updated: 2025-12-05T10:24:54Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1103/physrevb.94.075417
intvolume: '        94'
issue: '7'
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Physical Review B
publication_identifier:
  issn:
  - 2469-9950
  - 2469-9969
publication_status: published
status: public
title: Surface vibrational Raman modes of In:Si(111)(4×1)and(8×2)nanowires
type: journal_article
user_id: '16199'
volume: 94
year: '2016'
...
---
_id: '13488'
author:
- first_name: I.
  full_name: Miccoli, I.
  last_name: Miccoli
- first_name: F.
  full_name: Edler, F.
  last_name: Edler
- first_name: H.
  full_name: Pfnür, H.
  last_name: Pfnür
- first_name: S.
  full_name: Appelfeller, S.
  last_name: Appelfeller
- first_name: M.
  full_name: Dähne, M.
  last_name: Dähne
- first_name: K.
  full_name: Holtgrewe, K.
  last_name: Holtgrewe
- first_name: S.
  full_name: Sanna, S.
  last_name: Sanna
- 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: Miccoli I, Edler F, Pfnür H, et al. Atomic size effects studied by transport
    in single silicide nanowires. <i>Physical Review B</i>. Published online 2016.
    doi:<a href="https://doi.org/10.1103/physrevb.93.125412">10.1103/physrevb.93.125412</a>
  apa: Miccoli, I., Edler, F., Pfnür, H., Appelfeller, S., Dähne, M., Holtgrewe, K.,
    Sanna, S., Schmidt, W. G., &#38; Tegenkamp, C. (2016). Atomic size effects studied
    by transport in single silicide nanowires. <i>Physical Review B</i>. <a href="https://doi.org/10.1103/physrevb.93.125412">https://doi.org/10.1103/physrevb.93.125412</a>
  bibtex: '@article{Miccoli_Edler_Pfnür_Appelfeller_Dähne_Holtgrewe_Sanna_Schmidt_Tegenkamp_2016,
    title={Atomic size effects studied by transport in single silicide nanowires},
    DOI={<a href="https://doi.org/10.1103/physrevb.93.125412">10.1103/physrevb.93.125412</a>},
    journal={Physical Review B}, author={Miccoli, I. and Edler, F. and Pfnür, H. and
    Appelfeller, S. and Dähne, M. and Holtgrewe, K. and Sanna, S. and Schmidt, Wolf
    Gero and Tegenkamp, C.}, year={2016} }'
  chicago: Miccoli, I., F. Edler, H. Pfnür, S. Appelfeller, M. Dähne, K. Holtgrewe,
    S. Sanna, Wolf Gero Schmidt, and C. Tegenkamp. “Atomic Size Effects Studied by
    Transport in Single Silicide Nanowires.” <i>Physical Review B</i>, 2016. <a href="https://doi.org/10.1103/physrevb.93.125412">https://doi.org/10.1103/physrevb.93.125412</a>.
  ieee: 'I. Miccoli <i>et al.</i>, “Atomic size effects studied by transport in single
    silicide nanowires,” <i>Physical Review B</i>, 2016, doi: <a href="https://doi.org/10.1103/physrevb.93.125412">10.1103/physrevb.93.125412</a>.'
  mla: Miccoli, I., et al. “Atomic Size Effects Studied by Transport in Single Silicide
    Nanowires.” <i>Physical Review B</i>, 2016, doi:<a href="https://doi.org/10.1103/physrevb.93.125412">10.1103/physrevb.93.125412</a>.
  short: I. Miccoli, F. Edler, H. Pfnür, S. Appelfeller, M. Dähne, K. Holtgrewe, S.
    Sanna, W.G. Schmidt, C. Tegenkamp, Physical Review B (2016).
date_created: 2019-09-30T12:19:46Z
date_updated: 2025-12-05T10:21:51Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1103/physrevb.93.125412
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Physical Review B
publication_identifier:
  issn:
  - 2469-9950
  - 2469-9969
publication_status: published
status: public
title: Atomic size effects studied by transport in single silicide nanowires
type: journal_article
user_id: '16199'
year: '2016'
...
---
_id: '13458'
author:
- first_name: M.
  full_name: Liebhaber, M.
  last_name: Liebhaber
- first_name: B.
  full_name: Halbig, B.
  last_name: Halbig
- first_name: U.
  full_name: Bass, U.
  last_name: Bass
- first_name: J.
  full_name: Geurts, J.
  last_name: Geurts
- first_name: Sergej
  full_name: Neufeld, Sergej
  id: '23261'
  last_name: Neufeld
- first_name: S.
  full_name: Sanna, S.
  last_name: Sanna
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: E.
  full_name: Speiser, E.
  last_name: Speiser
- first_name: J.
  full_name: Räthel, J.
  last_name: Räthel
- first_name: S.
  full_name: Chandola, S.
  last_name: Chandola
- first_name: N.
  full_name: Esser, N.
  last_name: Esser
citation:
  ama: Liebhaber M, Halbig B, Bass U, et al. Vibration eigenmodes of the Au-(5×2)/Si(111)
    surface studied by Raman spectroscopy and first-principles calculations. <i>Physical
    Review B</i>. 2016;94(23). doi:<a href="https://doi.org/10.1103/physrevb.94.235304">10.1103/physrevb.94.235304</a>
  apa: Liebhaber, M., Halbig, B., Bass, U., Geurts, J., Neufeld, S., Sanna, S., Schmidt,
    W. G., Speiser, E., Räthel, J., Chandola, S., &#38; Esser, N. (2016). Vibration
    eigenmodes of the Au-(5×2)/Si(111) surface studied by Raman spectroscopy and first-principles
    calculations. <i>Physical Review B</i>, <i>94</i>(23). <a href="https://doi.org/10.1103/physrevb.94.235304">https://doi.org/10.1103/physrevb.94.235304</a>
  bibtex: '@article{Liebhaber_Halbig_Bass_Geurts_Neufeld_Sanna_Schmidt_Speiser_Räthel_Chandola_et
    al._2016, title={Vibration eigenmodes of the Au-(5×2)/Si(111) surface studied
    by Raman spectroscopy and first-principles calculations}, volume={94}, DOI={<a
    href="https://doi.org/10.1103/physrevb.94.235304">10.1103/physrevb.94.235304</a>},
    number={23}, journal={Physical Review B}, author={Liebhaber, M. and Halbig, B.
    and Bass, U. and Geurts, J. and Neufeld, Sergej and Sanna, S. and Schmidt, Wolf
    Gero and Speiser, E. and Räthel, J. and Chandola, S. and et al.}, year={2016}
    }'
  chicago: Liebhaber, M., B. Halbig, U. Bass, J. Geurts, Sergej Neufeld, S. Sanna,
    Wolf Gero Schmidt, et al. “Vibration Eigenmodes of the Au-(5×2)/Si(111) Surface
    Studied by Raman Spectroscopy and First-Principles Calculations.” <i>Physical
    Review B</i> 94, no. 23 (2016). <a href="https://doi.org/10.1103/physrevb.94.235304">https://doi.org/10.1103/physrevb.94.235304</a>.
  ieee: 'M. Liebhaber <i>et al.</i>, “Vibration eigenmodes of the Au-(5×2)/Si(111)
    surface studied by Raman spectroscopy and first-principles calculations,” <i>Physical
    Review B</i>, vol. 94, no. 23, 2016, doi: <a href="https://doi.org/10.1103/physrevb.94.235304">10.1103/physrevb.94.235304</a>.'
  mla: Liebhaber, M., et al. “Vibration Eigenmodes of the Au-(5×2)/Si(111) Surface
    Studied by Raman Spectroscopy and First-Principles Calculations.” <i>Physical
    Review B</i>, vol. 94, no. 23, 2016, doi:<a href="https://doi.org/10.1103/physrevb.94.235304">10.1103/physrevb.94.235304</a>.
  short: M. Liebhaber, B. Halbig, U. Bass, J. Geurts, S. Neufeld, S. Sanna, W.G. Schmidt,
    E. Speiser, J. Räthel, S. Chandola, N. Esser, Physical Review B 94 (2016).
date_created: 2019-09-30T08:22:04Z
date_updated: 2025-12-05T10:28:47Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '230'
- _id: '35'
- _id: '27'
doi: 10.1103/physrevb.94.235304
intvolume: '        94'
issue: '23'
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Physical Review B
publication_identifier:
  issn:
  - 2469-9950
  - 2469-9969
publication_status: published
status: public
title: Vibration eigenmodes of the Au-(5×2)/Si(111) surface studied by Raman spectroscopy
  and first-principles calculations
type: journal_article
user_id: '16199'
volume: 94
year: '2016'
...
