---
_id: '62076'
article_number: '113274'
author:
- first_name: Johannes
  full_name: Gerritzen, Johannes
  id: '105344'
  last_name: Gerritzen
  orcid: 0000-0002-0169-8602
- first_name: Andreas
  full_name: Hornig, Andreas
  last_name: Hornig
- first_name: Peter
  full_name: Winkler, Peter
  last_name: Winkler
- first_name: Maik
  full_name: Gude, Maik
  last_name: Gude
citation:
  ama: Gerritzen J, Hornig A, Winkler P, Gude M. A methodology for direct parameter
    identification for experimental results using machine learning — Real world application
    to the highly non-linear deformation behavior of FRP. <i>Computational Materials
    Science</i>. 2024;244. doi:<a href="https://doi.org/10.1016/j.commatsci.2024.113274">10.1016/j.commatsci.2024.113274</a>
  apa: Gerritzen, J., Hornig, A., Winkler, P., &#38; Gude, M. (2024). A methodology
    for direct parameter identification for experimental results using machine learning
    — Real world application to the highly non-linear deformation behavior of FRP.
    <i>Computational Materials Science</i>, <i>244</i>, Article 113274. <a href="https://doi.org/10.1016/j.commatsci.2024.113274">https://doi.org/10.1016/j.commatsci.2024.113274</a>
  bibtex: '@article{Gerritzen_Hornig_Winkler_Gude_2024, title={A methodology for direct
    parameter identification for experimental results using machine learning — Real
    world application to the highly non-linear deformation behavior of FRP}, volume={244},
    DOI={<a href="https://doi.org/10.1016/j.commatsci.2024.113274">10.1016/j.commatsci.2024.113274</a>},
    number={113274}, journal={Computational Materials Science}, publisher={Elsevier
    BV}, author={Gerritzen, Johannes and Hornig, Andreas and Winkler, Peter and Gude,
    Maik}, year={2024} }'
  chicago: Gerritzen, Johannes, Andreas Hornig, Peter Winkler, and Maik Gude. “A Methodology
    for Direct Parameter Identification for Experimental Results Using Machine Learning
    — Real World Application to the Highly Non-Linear Deformation Behavior of FRP.”
    <i>Computational Materials Science</i> 244 (2024). <a href="https://doi.org/10.1016/j.commatsci.2024.113274">https://doi.org/10.1016/j.commatsci.2024.113274</a>.
  ieee: 'J. Gerritzen, A. Hornig, P. Winkler, and M. Gude, “A methodology for direct
    parameter identification for experimental results using machine learning — Real
    world application to the highly non-linear deformation behavior of FRP,” <i>Computational
    Materials Science</i>, vol. 244, Art. no. 113274, 2024, doi: <a href="https://doi.org/10.1016/j.commatsci.2024.113274">10.1016/j.commatsci.2024.113274</a>.'
  mla: Gerritzen, Johannes, et al. “A Methodology for Direct Parameter Identification
    for Experimental Results Using Machine Learning — Real World Application to the
    Highly Non-Linear Deformation Behavior of FRP.” <i>Computational Materials Science</i>,
    vol. 244, 113274, Elsevier BV, 2024, doi:<a href="https://doi.org/10.1016/j.commatsci.2024.113274">10.1016/j.commatsci.2024.113274</a>.
  short: J. Gerritzen, A. Hornig, P. Winkler, M. Gude, Computational Materials Science
    244 (2024).
date_created: 2025-11-04T12:37:42Z
date_updated: 2026-02-27T06:46:35Z
doi: 10.1016/j.commatsci.2024.113274
intvolume: '       244'
language:
- iso: eng
project:
- _id: '130'
  name: 'TRR 285:  Methodenentwicklung zur mechanischen Fügbarkeit in wandlungsfähigen
    Prozessketten'
- _id: '137'
  name: TRR 285 - Subproject A03
- _id: '131'
  name: TRR 285 - Project Area A
publication: Computational Materials Science
publication_identifier:
  issn:
  - 0927-0256
publication_status: published
publisher: Elsevier BV
status: public
title: A methodology for direct parameter identification for experimental results
  using machine learning — Real world application to the highly non-linear deformation
  behavior of FRP
type: journal_article
user_id: '105344'
volume: 244
year: '2024'
...
---
_id: '33657'
article_number: '110567'
author:
- first_name: Hossein
  full_name: Mirhosseini, Hossein
  id: '71051'
  last_name: Mirhosseini
  orcid: 0000-0001-6179-1545
- first_name: Hossein
  full_name: Tahmasbi, Hossein
  last_name: Tahmasbi
- first_name: Sai Ram
  full_name: Kuchana, Sai Ram
  last_name: Kuchana
- first_name: Alireza
  full_name: Ghasemi, Alireza
  id: '77282'
  last_name: Ghasemi
- first_name: Thomas
  full_name: Kühne, Thomas
  id: '49079'
  last_name: Kühne
citation:
  ama: Mirhosseini H, Tahmasbi H, Kuchana SR, Ghasemi A, Kühne T. An automated approach
    for developing neural network interatomic potentials with FLAME. <i>Computational
    Materials Science</i>. 2021;197. doi:<a href="https://doi.org/10.1016/j.commatsci.2021.110567">10.1016/j.commatsci.2021.110567</a>
  apa: Mirhosseini, H., Tahmasbi, H., Kuchana, S. R., Ghasemi, A., &#38; Kühne, T.
    (2021). An automated approach for developing neural network interatomic potentials
    with FLAME. <i>Computational Materials Science</i>, <i>197</i>, Article 110567.
    <a href="https://doi.org/10.1016/j.commatsci.2021.110567">https://doi.org/10.1016/j.commatsci.2021.110567</a>
  bibtex: '@article{Mirhosseini_Tahmasbi_Kuchana_Ghasemi_Kühne_2021, title={An automated
    approach for developing neural network interatomic potentials with FLAME}, volume={197},
    DOI={<a href="https://doi.org/10.1016/j.commatsci.2021.110567">10.1016/j.commatsci.2021.110567</a>},
    number={110567}, journal={Computational Materials Science}, publisher={Elsevier
    BV}, author={Mirhosseini, Hossein and Tahmasbi, Hossein and Kuchana, Sai Ram and
    Ghasemi, Alireza and Kühne, Thomas}, year={2021} }'
  chicago: Mirhosseini, Hossein, Hossein Tahmasbi, Sai Ram Kuchana, Alireza Ghasemi,
    and Thomas Kühne. “An Automated Approach for Developing Neural Network Interatomic
    Potentials with FLAME.” <i>Computational Materials Science</i> 197 (2021). <a
    href="https://doi.org/10.1016/j.commatsci.2021.110567">https://doi.org/10.1016/j.commatsci.2021.110567</a>.
  ieee: 'H. Mirhosseini, H. Tahmasbi, S. R. Kuchana, A. Ghasemi, and T. Kühne, “An
    automated approach for developing neural network interatomic potentials with FLAME,”
    <i>Computational Materials Science</i>, vol. 197, Art. no. 110567, 2021, doi:
    <a href="https://doi.org/10.1016/j.commatsci.2021.110567">10.1016/j.commatsci.2021.110567</a>.'
  mla: Mirhosseini, Hossein, et al. “An Automated Approach for Developing Neural Network
    Interatomic Potentials with FLAME.” <i>Computational Materials Science</i>, vol.
    197, 110567, Elsevier BV, 2021, doi:<a href="https://doi.org/10.1016/j.commatsci.2021.110567">10.1016/j.commatsci.2021.110567</a>.
  short: H. Mirhosseini, H. Tahmasbi, S.R. Kuchana, A. Ghasemi, T. Kühne, Computational
    Materials Science 197 (2021).
date_created: 2022-10-10T08:23:50Z
date_updated: 2022-10-10T08:24:13Z
department:
- _id: '613'
doi: 10.1016/j.commatsci.2021.110567
intvolume: '       197'
keyword:
- Computational Mathematics
- General Physics and Astronomy
- Mechanics of Materials
- General Materials Science
- General Chemistry
- General Computer Science
language:
- iso: eng
publication: Computational Materials Science
publication_identifier:
  issn:
  - 0927-0256
publication_status: published
publisher: Elsevier BV
status: public
title: An automated approach for developing neural network interatomic potentials
  with FLAME
type: journal_article
user_id: '71051'
volume: 197
year: '2021'
...
---
_id: '10033'
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>. 2015:145-150. 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>,
    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}, 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>,
    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>,
    pp. 145–150, 2015.
  mla: Sanna, S., et al. “Modeling Atomic Force Microscopy at LiNbO 3 Surfaces from
    First-Principles.” <i>Computational Materials Science</i>, 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 (2015) 145–150.
date_created: 2019-05-29T08:50:16Z
date_updated: 2022-01-06T06:50:27Z
department:
- _id: '15'
doi: 10.1016/j.commatsci.2015.03.025
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: '69'
  name: TRR 142 - Subproject B4
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'
year: '2015'
...
---
_id: '24698'
author:
- first_name: C.
  full_name: Cheng, C.
  last_name: Cheng
- first_name: Rolf
  full_name: Mahnken, Rolf
  id: '335'
  last_name: Mahnken
citation:
  ama: Cheng C, Mahnken R. A multi-mechanism model for cutting simulations based on
    the concept of generalized stresses. <i>Computational Materials Science</i>. Published
    online 2015:144-158. doi:<a href="https://doi.org/10.1016/j.commatsci.2014.12.028">10.1016/j.commatsci.2014.12.028</a>
  apa: Cheng, C., &#38; Mahnken, R. (2015). A multi-mechanism model for cutting simulations
    based on the concept of generalized stresses. <i>Computational Materials Science</i>,
    144–158. <a href="https://doi.org/10.1016/j.commatsci.2014.12.028">https://doi.org/10.1016/j.commatsci.2014.12.028</a>
  bibtex: '@article{Cheng_Mahnken_2015, title={A multi-mechanism model for cutting
    simulations based on the concept of generalized stresses}, DOI={<a href="https://doi.org/10.1016/j.commatsci.2014.12.028">10.1016/j.commatsci.2014.12.028</a>},
    journal={Computational Materials Science}, author={Cheng, C. and Mahnken, Rolf},
    year={2015}, pages={144–158} }'
  chicago: Cheng, C., and Rolf Mahnken. “A Multi-Mechanism Model for Cutting Simulations
    Based on the Concept of Generalized Stresses.” <i>Computational Materials Science</i>,
    2015, 144–58. <a href="https://doi.org/10.1016/j.commatsci.2014.12.028">https://doi.org/10.1016/j.commatsci.2014.12.028</a>.
  ieee: 'C. Cheng and R. Mahnken, “A multi-mechanism model for cutting simulations
    based on the concept of generalized stresses,” <i>Computational Materials Science</i>,
    pp. 144–158, 2015, doi: <a href="https://doi.org/10.1016/j.commatsci.2014.12.028">10.1016/j.commatsci.2014.12.028</a>.'
  mla: Cheng, C., and Rolf Mahnken. “A Multi-Mechanism Model for Cutting Simulations
    Based on the Concept of Generalized Stresses.” <i>Computational Materials Science</i>,
    2015, pp. 144–58, doi:<a href="https://doi.org/10.1016/j.commatsci.2014.12.028">10.1016/j.commatsci.2014.12.028</a>.
  short: C. Cheng, R. Mahnken, Computational Materials Science (2015) 144–158.
date_created: 2021-09-20T11:01:31Z
date_updated: 2023-01-24T14:34:36Z
department:
- _id: '9'
- _id: '154'
- _id: '321'
doi: 10.1016/j.commatsci.2014.12.028
language:
- iso: eng
page: 144-158
publication: Computational Materials Science
publication_identifier:
  issn:
  - 0927-0256
publication_status: published
quality_controlled: '1'
status: public
title: A multi-mechanism model for cutting simulations based on the concept of generalized
  stresses
type: journal_article
user_id: '335'
year: '2015'
...
---
_id: '24650'
author:
- first_name: M.
  full_name: Düsing, M.
  last_name: Düsing
- first_name: Rolf
  full_name: Mahnken, Rolf
  id: '335'
  last_name: Mahnken
citation:
  ama: Düsing M, Mahnken R. Simulation of lower bainitic transformation with the phase-field
    method considering carbide formation. <i>Computational Materials Science</i>.
    Published online 2015:91-100. doi:<a href="https://doi.org/10.1016/j.commatsci.2015.08.043">10.1016/j.commatsci.2015.08.043</a>
  apa: Düsing, M., &#38; Mahnken, R. (2015). Simulation of lower bainitic transformation
    with the phase-field method considering carbide formation. <i>Computational Materials
    Science</i>, 91–100. <a href="https://doi.org/10.1016/j.commatsci.2015.08.043">https://doi.org/10.1016/j.commatsci.2015.08.043</a>
  bibtex: '@article{Düsing_Mahnken_2015, title={Simulation of lower bainitic transformation
    with the phase-field method considering carbide formation}, DOI={<a href="https://doi.org/10.1016/j.commatsci.2015.08.043">10.1016/j.commatsci.2015.08.043</a>},
    journal={Computational Materials Science}, author={Düsing, M. and Mahnken, Rolf},
    year={2015}, pages={91–100} }'
  chicago: Düsing, M., and Rolf Mahnken. “Simulation of Lower Bainitic Transformation
    with the Phase-Field Method Considering Carbide Formation.” <i>Computational Materials
    Science</i>, 2015, 91–100. <a href="https://doi.org/10.1016/j.commatsci.2015.08.043">https://doi.org/10.1016/j.commatsci.2015.08.043</a>.
  ieee: 'M. Düsing and R. Mahnken, “Simulation of lower bainitic transformation with
    the phase-field method considering carbide formation,” <i>Computational Materials
    Science</i>, pp. 91–100, 2015, doi: <a href="https://doi.org/10.1016/j.commatsci.2015.08.043">10.1016/j.commatsci.2015.08.043</a>.'
  mla: Düsing, M., and Rolf Mahnken. “Simulation of Lower Bainitic Transformation
    with the Phase-Field Method Considering Carbide Formation.” <i>Computational Materials
    Science</i>, 2015, pp. 91–100, doi:<a href="https://doi.org/10.1016/j.commatsci.2015.08.043">10.1016/j.commatsci.2015.08.043</a>.
  short: M. Düsing, R. Mahnken, Computational Materials Science (2015) 91–100.
date_created: 2021-09-17T10:20:09Z
date_updated: 2023-01-24T14:32:00Z
department:
- _id: '9'
- _id: '154'
- _id: '321'
doi: 10.1016/j.commatsci.2015.08.043
language:
- iso: eng
page: 91-100
publication: Computational Materials Science
publication_identifier:
  issn:
  - 0927-0256
publication_status: published
quality_controlled: '1'
status: public
title: Simulation of lower bainitic transformation with the phase-field method considering
  carbide formation
type: journal_article
user_id: '335'
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: '62787'
author:
- first_name: Richard
  full_name: Ostwald, Richard
  id: '106876'
  last_name: Ostwald
  orcid: 0000-0003-2147-8444
- first_name: Thorsten
  full_name: Bartel, Thorsten
  last_name: Bartel
- first_name: Andreas
  full_name: Menzel, Andreas
  last_name: Menzel
citation:
  ama: Ostwald R, Bartel T, Menzel A. Phase-transformations interacting with plasticity
    – A micro-sphere model applied to TRIP steel. <i>Computational Materials Science</i>.
    2012;64:12-16. doi:<a href="https://doi.org/10.1016/j.commatsci.2012.05.015">10.1016/j.commatsci.2012.05.015</a>
  apa: Ostwald, R., Bartel, T., &#38; Menzel, A. (2012). Phase-transformations interacting
    with plasticity – A micro-sphere model applied to TRIP steel. <i>Computational
    Materials Science</i>, <i>64</i>, 12–16. <a href="https://doi.org/10.1016/j.commatsci.2012.05.015">https://doi.org/10.1016/j.commatsci.2012.05.015</a>
  bibtex: '@article{Ostwald_Bartel_Menzel_2012, title={Phase-transformations interacting
    with plasticity – A micro-sphere model applied to TRIP steel}, volume={64}, DOI={<a
    href="https://doi.org/10.1016/j.commatsci.2012.05.015">10.1016/j.commatsci.2012.05.015</a>},
    journal={Computational Materials Science}, publisher={Elsevier BV}, author={Ostwald,
    Richard and Bartel, Thorsten and Menzel, Andreas}, year={2012}, pages={12–16}
    }'
  chicago: 'Ostwald, Richard, Thorsten Bartel, and Andreas Menzel. “Phase-Transformations
    Interacting with Plasticity – A Micro-Sphere Model Applied to TRIP Steel.” <i>Computational
    Materials Science</i> 64 (2012): 12–16. <a href="https://doi.org/10.1016/j.commatsci.2012.05.015">https://doi.org/10.1016/j.commatsci.2012.05.015</a>.'
  ieee: 'R. Ostwald, T. Bartel, and A. Menzel, “Phase-transformations interacting
    with plasticity – A micro-sphere model applied to TRIP steel,” <i>Computational
    Materials Science</i>, vol. 64, pp. 12–16, 2012, doi: <a href="https://doi.org/10.1016/j.commatsci.2012.05.015">10.1016/j.commatsci.2012.05.015</a>.'
  mla: Ostwald, Richard, et al. “Phase-Transformations Interacting with Plasticity
    – A Micro-Sphere Model Applied to TRIP Steel.” <i>Computational Materials Science</i>,
    vol. 64, Elsevier BV, 2012, pp. 12–16, doi:<a href="https://doi.org/10.1016/j.commatsci.2012.05.015">10.1016/j.commatsci.2012.05.015</a>.
  short: R. Ostwald, T. Bartel, A. Menzel, Computational Materials Science 64 (2012)
    12–16.
date_created: 2025-12-03T13:16:44Z
date_updated: 2025-12-03T13:17:26Z
department:
- _id: '952'
- _id: '321'
doi: 10.1016/j.commatsci.2012.05.015
intvolume: '        64'
language:
- iso: eng
page: 12-16
publication: Computational Materials Science
publication_identifier:
  issn:
  - 0927-0256
publication_status: published
publisher: Elsevier BV
quality_controlled: '1'
status: public
title: Phase-transformations interacting with plasticity – A micro-sphere model applied
  to TRIP steel
type: journal_article
user_id: '85414'
volume: 64
year: '2012'
...
---
_id: '25089'
author:
- first_name: Rolf
  full_name: Mahnken, Rolf
  id: '335'
  last_name: Mahnken
- first_name: Stefan
  full_name: Wilmanns, Stefan
  last_name: Wilmanns
citation:
  ama: Mahnken R, Wilmanns S. A projected Newton algorithm for simulation of multi-variant
    textured polycrystalline shape memory alloys. <i>Computational Materials Science</i>.
    Published online 2011:2535-2548. doi:<a href="https://doi.org/10.1016/j.commatsci.2011.03.010">10.1016/j.commatsci.2011.03.010</a>
  apa: Mahnken, R., &#38; Wilmanns, S. (2011). A projected Newton algorithm for simulation
    of multi-variant textured polycrystalline shape memory alloys. <i>Computational
    Materials Science</i>, 2535–2548. <a href="https://doi.org/10.1016/j.commatsci.2011.03.010">https://doi.org/10.1016/j.commatsci.2011.03.010</a>
  bibtex: '@article{Mahnken_Wilmanns_2011, title={A projected Newton algorithm for
    simulation of multi-variant textured polycrystalline shape memory alloys}, DOI={<a
    href="https://doi.org/10.1016/j.commatsci.2011.03.010">10.1016/j.commatsci.2011.03.010</a>},
    journal={Computational Materials Science}, author={Mahnken, Rolf and Wilmanns,
    Stefan}, year={2011}, pages={2535–2548} }'
  chicago: Mahnken, Rolf, and Stefan Wilmanns. “A Projected Newton Algorithm for Simulation
    of Multi-Variant Textured Polycrystalline Shape Memory Alloys.” <i>Computational
    Materials Science</i>, 2011, 2535–48. <a href="https://doi.org/10.1016/j.commatsci.2011.03.010">https://doi.org/10.1016/j.commatsci.2011.03.010</a>.
  ieee: 'R. Mahnken and S. Wilmanns, “A projected Newton algorithm for simulation
    of multi-variant textured polycrystalline shape memory alloys,” <i>Computational
    Materials Science</i>, pp. 2535–2548, 2011, doi: <a href="https://doi.org/10.1016/j.commatsci.2011.03.010">10.1016/j.commatsci.2011.03.010</a>.'
  mla: Mahnken, Rolf, and Stefan Wilmanns. “A Projected Newton Algorithm for Simulation
    of Multi-Variant Textured Polycrystalline Shape Memory Alloys.” <i>Computational
    Materials Science</i>, 2011, pp. 2535–48, doi:<a href="https://doi.org/10.1016/j.commatsci.2011.03.010">10.1016/j.commatsci.2011.03.010</a>.
  short: R. Mahnken, S. Wilmanns, Computational Materials Science (2011) 2535–2548.
date_created: 2021-09-28T13:06:34Z
date_updated: 2023-01-24T15:13:42Z
department:
- _id: '9'
- _id: '154'
doi: 10.1016/j.commatsci.2011.03.010
language:
- iso: eng
page: 2535-2548
publication: Computational Materials Science
publication_identifier:
  issn:
  - 0927-0256
publication_status: published
quality_controlled: '1'
status: public
title: A projected Newton algorithm for simulation of multi-variant textured polycrystalline
  shape memory alloys
type: journal_article
user_id: '335'
year: '2011'
...
---
_id: '25085'
author:
- first_name: Rolf
  full_name: Mahnken, Rolf
  id: '335'
  last_name: Mahnken
- first_name: A.
  full_name: Schneidt, A.
  last_name: Schneidt
- first_name: S.
  full_name: Tschumak, S.
  last_name: Tschumak
- first_name: H.J.
  full_name: Maier, H.J.
  last_name: Maier
citation:
  ama: Mahnken R, Schneidt A, Tschumak S, Maier HJ. On the simulation of austenite
    to bainite phase transformation. <i>Computational Materials Science</i>. Published
    online 2011:1823-1829. doi:<a href="https://doi.org/10.1016/j.commatsci.2010.12.032">10.1016/j.commatsci.2010.12.032</a>
  apa: Mahnken, R., Schneidt, A., Tschumak, S., &#38; Maier, H. J. (2011). On the
    simulation of austenite to bainite phase transformation. <i>Computational Materials
    Science</i>, 1823–1829. <a href="https://doi.org/10.1016/j.commatsci.2010.12.032">https://doi.org/10.1016/j.commatsci.2010.12.032</a>
  bibtex: '@article{Mahnken_Schneidt_Tschumak_Maier_2011, title={On the simulation
    of austenite to bainite phase transformation}, DOI={<a href="https://doi.org/10.1016/j.commatsci.2010.12.032">10.1016/j.commatsci.2010.12.032</a>},
    journal={Computational Materials Science}, author={Mahnken, Rolf and Schneidt,
    A. and Tschumak, S. and Maier, H.J.}, year={2011}, pages={1823–1829} }'
  chicago: Mahnken, Rolf, A. Schneidt, S. Tschumak, and H.J. Maier. “On the Simulation
    of Austenite to Bainite Phase Transformation.” <i>Computational Materials Science</i>,
    2011, 1823–29. <a href="https://doi.org/10.1016/j.commatsci.2010.12.032">https://doi.org/10.1016/j.commatsci.2010.12.032</a>.
  ieee: 'R. Mahnken, A. Schneidt, S. Tschumak, and H. J. Maier, “On the simulation
    of austenite to bainite phase transformation,” <i>Computational Materials Science</i>,
    pp. 1823–1829, 2011, doi: <a href="https://doi.org/10.1016/j.commatsci.2010.12.032">10.1016/j.commatsci.2010.12.032</a>.'
  mla: Mahnken, Rolf, et al. “On the Simulation of Austenite to Bainite Phase Transformation.”
    <i>Computational Materials Science</i>, 2011, pp. 1823–29, doi:<a href="https://doi.org/10.1016/j.commatsci.2010.12.032">10.1016/j.commatsci.2010.12.032</a>.
  short: R. Mahnken, A. Schneidt, S. Tschumak, H.J. Maier, Computational Materials
    Science (2011) 1823–1829.
date_created: 2021-09-28T13:04:47Z
date_updated: 2023-01-24T15:13:07Z
department:
- _id: '9'
- _id: '154'
doi: 10.1016/j.commatsci.2010.12.032
language:
- iso: eng
page: 1823-1829
publication: Computational Materials Science
publication_identifier:
  issn:
  - 0927-0256
publication_status: published
quality_controlled: '1'
status: public
title: On the simulation of austenite to bainite phase transformation
type: journal_article
user_id: '335'
year: '2011'
...
---
_id: '13829'
author:
- first_name: A.V.
  full_name: Krivosheeva, A.V.
  last_name: Krivosheeva
- 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
citation:
  ama: Krivosheeva AV, Sanna S, Schmidt WG. First-principles investigation of CO adsorption
    on Pt/Ge(001)-(4×2). <i>Computational Materials Science</i>. 2010;49(4):895-898.
    doi:<a href="https://doi.org/10.1016/j.commatsci.2010.06.043">10.1016/j.commatsci.2010.06.043</a>
  apa: Krivosheeva, A. V., Sanna, S., &#38; Schmidt, W. G. (2010). First-principles
    investigation of CO adsorption on Pt/Ge(001)-(4×2). <i>Computational Materials
    Science</i>, <i>49</i>(4), 895–898. <a href="https://doi.org/10.1016/j.commatsci.2010.06.043">https://doi.org/10.1016/j.commatsci.2010.06.043</a>
  bibtex: '@article{Krivosheeva_Sanna_Schmidt_2010, title={First-principles investigation
    of CO adsorption on Pt/Ge(001)-(4×2)}, volume={49}, DOI={<a href="https://doi.org/10.1016/j.commatsci.2010.06.043">10.1016/j.commatsci.2010.06.043</a>},
    number={4}, journal={Computational Materials Science}, author={Krivosheeva, A.V.
    and Sanna, S. and Schmidt, Wolf Gero}, year={2010}, pages={895–898} }'
  chicago: 'Krivosheeva, A.V., S. Sanna, and Wolf Gero Schmidt. “First-Principles
    Investigation of CO Adsorption on Pt/Ge(001)-(4×2).” <i>Computational Materials
    Science</i> 49, no. 4 (2010): 895–98. <a href="https://doi.org/10.1016/j.commatsci.2010.06.043">https://doi.org/10.1016/j.commatsci.2010.06.043</a>.'
  ieee: 'A. V. Krivosheeva, S. Sanna, and W. G. Schmidt, “First-principles investigation
    of CO adsorption on Pt/Ge(001)-(4×2),” <i>Computational Materials Science</i>,
    vol. 49, no. 4, pp. 895–898, 2010, doi: <a href="https://doi.org/10.1016/j.commatsci.2010.06.043">10.1016/j.commatsci.2010.06.043</a>.'
  mla: Krivosheeva, A. V., et al. “First-Principles Investigation of CO Adsorption
    on Pt/Ge(001)-(4×2).” <i>Computational Materials Science</i>, vol. 49, no. 4,
    2010, pp. 895–98, doi:<a href="https://doi.org/10.1016/j.commatsci.2010.06.043">10.1016/j.commatsci.2010.06.043</a>.
  short: A.V. Krivosheeva, S. Sanna, W.G. Schmidt, Computational Materials Science
    49 (2010) 895–898.
date_created: 2019-10-15T07:32:45Z
date_updated: 2025-12-16T07:49:36Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1016/j.commatsci.2010.06.043
funded_apc: '1'
intvolume: '        49'
issue: '4'
language:
- iso: eng
page: 895-898
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Computational Materials Science
publication_identifier:
  issn:
  - 0927-0256
publication_status: published
status: public
title: First-principles investigation of CO adsorption on Pt/Ge(001)-(4×2)
type: journal_article
user_id: '16199'
volume: 49
year: '2010'
...
---
_id: '26272'
author:
- first_name: Rolf
  full_name: Mahnken, Rolf
  id: '335'
  last_name: Mahnken
- first_name: Stefan
  full_name: Wilmanns, Stefan
  last_name: Wilmanns
citation:
  ama: Mahnken R, Wilmanns S. Simulation of asymmetric effects for shape memory alloys
    by decomposition of transformation strains. <i>Computational Materials Science</i>.
    Published online 2007:295-305. doi:<a href="https://doi.org/10.1016/j.commatsci.2007.07.042">10.1016/j.commatsci.2007.07.042</a>
  apa: Mahnken, R., &#38; Wilmanns, S. (2007). Simulation of asymmetric effects for
    shape memory alloys by decomposition of transformation strains. <i>Computational
    Materials Science</i>, 295–305. <a href="https://doi.org/10.1016/j.commatsci.2007.07.042">https://doi.org/10.1016/j.commatsci.2007.07.042</a>
  bibtex: '@article{Mahnken_Wilmanns_2007, title={Simulation of asymmetric effects
    for shape memory alloys by decomposition of transformation strains}, DOI={<a href="https://doi.org/10.1016/j.commatsci.2007.07.042">10.1016/j.commatsci.2007.07.042</a>},
    journal={Computational Materials Science}, author={Mahnken, Rolf and Wilmanns,
    Stefan}, year={2007}, pages={295–305} }'
  chicago: Mahnken, Rolf, and Stefan Wilmanns. “Simulation of Asymmetric Effects for
    Shape Memory Alloys by Decomposition of Transformation Strains.” <i>Computational
    Materials Science</i>, 2007, 295–305. <a href="https://doi.org/10.1016/j.commatsci.2007.07.042">https://doi.org/10.1016/j.commatsci.2007.07.042</a>.
  ieee: 'R. Mahnken and S. Wilmanns, “Simulation of asymmetric effects for shape memory
    alloys by decomposition of transformation strains,” <i>Computational Materials
    Science</i>, pp. 295–305, 2007, doi: <a href="https://doi.org/10.1016/j.commatsci.2007.07.042">10.1016/j.commatsci.2007.07.042</a>.'
  mla: Mahnken, Rolf, and Stefan Wilmanns. “Simulation of Asymmetric Effects for Shape
    Memory Alloys by Decomposition of Transformation Strains.” <i>Computational Materials
    Science</i>, 2007, pp. 295–305, doi:<a href="https://doi.org/10.1016/j.commatsci.2007.07.042">10.1016/j.commatsci.2007.07.042</a>.
  short: R. Mahnken, S. Wilmanns, Computational Materials Science (2007) 295–305.
date_created: 2021-10-15T11:27:25Z
date_updated: 2023-01-25T14:31:59Z
department:
- _id: '9'
- _id: '154'
doi: 10.1016/j.commatsci.2007.07.042
language:
- iso: eng
page: 295-305
publication: Computational Materials Science
publication_identifier:
  issn:
  - 0927-0256
publication_status: published
quality_controlled: '1'
status: public
title: Simulation of asymmetric effects for shape memory alloys by decomposition of
  transformation strains
type: journal_article
user_id: '335'
year: '2007'
...
---
_id: '13750'
author:
- first_name: O.
  full_name: Pulci, O.
  last_name: Pulci
- first_name: K.
  full_name: Lüdge, K.
  last_name: Lüdge
- first_name: P.
  full_name: Vogt, P.
  last_name: Vogt
- first_name: N.
  full_name: Esser, N.
  last_name: Esser
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: W.
  full_name: Richter, W.
  last_name: Richter
- first_name: F.
  full_name: Bechstedt, F.
  last_name: Bechstedt
citation:
  ama: Pulci O, Lüdge K, Vogt P, et al. First-principles study of InP and GaP(001)
    surfaces. <i>Computational Materials Science</i>. Published online 2002:32-37.
    doi:<a href="https://doi.org/10.1016/s0927-0256(01)00161-6">10.1016/s0927-0256(01)00161-6</a>
  apa: Pulci, O., Lüdge, K., Vogt, P., Esser, N., Schmidt, W. G., Richter, W., &#38;
    Bechstedt, F. (2002). First-principles study of InP and GaP(001) surfaces. <i>Computational
    Materials Science</i>, 32–37. <a href="https://doi.org/10.1016/s0927-0256(01)00161-6">https://doi.org/10.1016/s0927-0256(01)00161-6</a>
  bibtex: '@article{Pulci_Lüdge_Vogt_Esser_Schmidt_Richter_Bechstedt_2002, title={First-principles
    study of InP and GaP(001) surfaces}, DOI={<a href="https://doi.org/10.1016/s0927-0256(01)00161-6">10.1016/s0927-0256(01)00161-6</a>},
    journal={Computational Materials Science}, author={Pulci, O. and Lüdge, K. and
    Vogt, P. and Esser, N. and Schmidt, Wolf Gero and Richter, W. and Bechstedt, F.},
    year={2002}, pages={32–37} }'
  chicago: Pulci, O., K. Lüdge, P. Vogt, N. Esser, Wolf Gero Schmidt, W. Richter,
    and F. Bechstedt. “First-Principles Study of InP and GaP(001) Surfaces.” <i>Computational
    Materials Science</i>, 2002, 32–37. <a href="https://doi.org/10.1016/s0927-0256(01)00161-6">https://doi.org/10.1016/s0927-0256(01)00161-6</a>.
  ieee: 'O. Pulci <i>et al.</i>, “First-principles study of InP and GaP(001) surfaces,”
    <i>Computational Materials Science</i>, pp. 32–37, 2002, doi: <a href="https://doi.org/10.1016/s0927-0256(01)00161-6">10.1016/s0927-0256(01)00161-6</a>.'
  mla: Pulci, O., et al. “First-Principles Study of InP and GaP(001) Surfaces.” <i>Computational
    Materials Science</i>, 2002, pp. 32–37, doi:<a href="https://doi.org/10.1016/s0927-0256(01)00161-6">10.1016/s0927-0256(01)00161-6</a>.
  short: O. Pulci, K. Lüdge, P. Vogt, N. Esser, W.G. Schmidt, W. Richter, F. Bechstedt,
    Computational Materials Science (2002) 32–37.
date_created: 2019-10-10T12:04:56Z
date_updated: 2025-12-16T07:17:25Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
doi: 10.1016/s0927-0256(01)00161-6
funded_apc: '1'
language:
- iso: eng
page: 32-37
publication: Computational Materials Science
publication_identifier:
  issn:
  - 0927-0256
publication_status: published
status: public
title: First-principles study of InP and GaP(001) surfaces
type: journal_article
user_id: '16199'
year: '2002'
...