---
_id: '13573'
abstract:
- lang: eng
  text: Given the vast range of lithium niobate (LiNbO3) applications, the knowledge
    about its electronic and optical properties is surprisingly limited. The direct
    band gap of 3.7 eV for the ferroelectric phase – frequently cited in the literature
    – is concluded from optical experiments. Recent theoretical investigations show
    that the electronic band‐structure and optical properties are very sensitive to
    quasiparticle and electron‐hole attraction effects, which were included using
    the GW approximation for the electron self‐energy and the Bethe‐Salpeter equation
    respectively, both based on a model screening function. The calculated fundamental
    gap was found to be at least 1 eV larger than the experimental value. To resolve
    this discrepancy we performed first‐principles GW calculations for lithium niobate
    using the full‐potential linearized augmented plane‐wave (FLAPW) method. Thereby
    we use the parameter‐free random phase approximation for a realistic description
    of the nonlocal and energydependent screening. This leads to a band gap of about
    4.7 (4.2) eV for ferro(para)‐electric lithium niobate.
article_type: original
author:
- first_name: Christian
  full_name: Thierfelder, Christian
  last_name: Thierfelder
- first_name: Simone
  full_name: Sanna, Simone
  last_name: Sanna
- 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: Thierfelder C, Sanna S, Schindlmayr A, Schmidt WG. Do we know the band gap
    of lithium niobate? <i>Physica Status Solidi C</i>. 2010;7(2):362-365. doi:<a
    href="https://doi.org/10.1002/pssc.200982473">10.1002/pssc.200982473</a>
  apa: Thierfelder, C., Sanna, S., Schindlmayr, A., &#38; Schmidt, W. G. (2010). Do
    we know the band gap of lithium niobate? <i>Physica Status Solidi C</i>, <i>7</i>(2),
    362–365. <a href="https://doi.org/10.1002/pssc.200982473">https://doi.org/10.1002/pssc.200982473</a>
  bibtex: '@article{Thierfelder_Sanna_Schindlmayr_Schmidt_2010, title={Do we know
    the band gap of lithium niobate?}, volume={7}, DOI={<a href="https://doi.org/10.1002/pssc.200982473">10.1002/pssc.200982473</a>},
    number={2}, journal={Physica Status Solidi C}, publisher={Wiley-VCH}, author={Thierfelder,
    Christian and Sanna, Simone and Schindlmayr, Arno and Schmidt, Wolf Gero}, year={2010},
    pages={362–365} }'
  chicago: 'Thierfelder, Christian, Simone Sanna, Arno Schindlmayr, and Wolf Gero
    Schmidt. “Do We Know the Band Gap of Lithium Niobate?” <i>Physica Status Solidi
    C</i> 7, no. 2 (2010): 362–65. <a href="https://doi.org/10.1002/pssc.200982473">https://doi.org/10.1002/pssc.200982473</a>.'
  ieee: 'C. Thierfelder, S. Sanna, A. Schindlmayr, and W. G. Schmidt, “Do we know
    the band gap of lithium niobate?,” <i>Physica Status Solidi C</i>, vol. 7, no.
    2, pp. 362–365, 2010, doi: <a href="https://doi.org/10.1002/pssc.200982473">10.1002/pssc.200982473</a>.'
  mla: Thierfelder, Christian, et al. “Do We Know the Band Gap of Lithium Niobate?”
    <i>Physica Status Solidi C</i>, vol. 7, no. 2, Wiley-VCH, 2010, pp. 362–65, doi:<a
    href="https://doi.org/10.1002/pssc.200982473">10.1002/pssc.200982473</a>.
  short: C. Thierfelder, S. Sanna, A. Schindlmayr, W.G. Schmidt, Physica Status Solidi
    C 7 (2010) 362–365.
conference:
  end_date: 2009-07-10
  location: Weimar
  name: 12th International Conference on the Formation of Semiconductor Interfaces
  start_date: 2009-07-05
date_created: 2019-10-01T09:18:29Z
date_updated: 2025-12-05T13:01:45Z
ddc:
- '530'
department:
- _id: '295'
- _id: '296'
- _id: '15'
- _id: '35'
- _id: '230'
- _id: '27'
- _id: '170'
doi: 10.1002/pssc.200982473
external_id:
  isi:
  - '000284313000057'
file:
- access_level: closed
  content_type: application/pdf
  creator: schindlm
  date_created: 2020-08-28T14:39:40Z
  date_updated: 2020-08-30T15:07:56Z
  description: © 2010 WILEY‐VCH Verlag GmbH & Co. KGaA, Weinheim
  file_id: '18583'
  file_name: pssc.200982473.pdf
  file_size: 212674
  relation: main_file
  title: Do we know the band gap of lithium niobate?
file_date_updated: 2020-08-30T15:07:56Z
has_accepted_license: '1'
intvolume: '         7'
isi: '1'
issue: '2'
language:
- iso: eng
page: 362-365
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Physica Status Solidi C
publication_identifier:
  eissn:
  - 1610-1642
  issn:
  - 1862-6351
publication_status: published
publisher: Wiley-VCH
quality_controlled: '1'
status: public
title: Do we know the band gap of lithium niobate?
type: journal_article
user_id: '16199'
volume: 7
year: '2010'
...
---
_id: '13574'
author:
- first_name: Uwe
  full_name: Gerstmann, Uwe
  id: '171'
  last_name: Gerstmann
  orcid: 0000-0002-4476-223X
- first_name: M.
  full_name: Rohrmüller, M.
  last_name: Rohrmüller
- first_name: F.
  full_name: Mauri, F.
  last_name: Mauri
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: 'Gerstmann U, Rohrmüller M, Mauri F, Schmidt WG. Ab initiog-tensor calculation
    for paramagnetic surface states: hydrogen adsorption at Si surfaces. <i>physica
    status solidi (c)</i>. 2010;7(2):157-160. doi:<a href="https://doi.org/10.1002/pssc.200982462">10.1002/pssc.200982462</a>'
  apa: 'Gerstmann, U., Rohrmüller, M., Mauri, F., &#38; Schmidt, W. G. (2010). Ab
    initiog-tensor calculation for paramagnetic surface states: hydrogen adsorption
    at Si surfaces. <i>Physica Status Solidi (c)</i>, <i>7</i>(2), 157–160. <a href="https://doi.org/10.1002/pssc.200982462">https://doi.org/10.1002/pssc.200982462</a>'
  bibtex: '@article{Gerstmann_Rohrmüller_Mauri_Schmidt_2010, title={Ab initiog-tensor
    calculation for paramagnetic surface states: hydrogen adsorption at Si surfaces},
    volume={7}, DOI={<a href="https://doi.org/10.1002/pssc.200982462">10.1002/pssc.200982462</a>},
    number={2}, journal={physica status solidi (c)}, author={Gerstmann, Uwe and Rohrmüller,
    M. and Mauri, F. and Schmidt, Wolf Gero}, year={2010}, pages={157–160} }'
  chicago: 'Gerstmann, Uwe, M. Rohrmüller, F. Mauri, and Wolf Gero Schmidt. “Ab Initiog-Tensor
    Calculation for Paramagnetic Surface States: Hydrogen Adsorption at Si Surfaces.”
    <i>Physica Status Solidi (c)</i> 7, no. 2 (2010): 157–60. <a href="https://doi.org/10.1002/pssc.200982462">https://doi.org/10.1002/pssc.200982462</a>.'
  ieee: 'U. Gerstmann, M. Rohrmüller, F. Mauri, and W. G. Schmidt, “Ab initiog-tensor
    calculation for paramagnetic surface states: hydrogen adsorption at Si surfaces,”
    <i>physica status solidi (c)</i>, vol. 7, no. 2, pp. 157–160, 2010, doi: <a href="https://doi.org/10.1002/pssc.200982462">10.1002/pssc.200982462</a>.'
  mla: 'Gerstmann, Uwe, et al. “Ab Initiog-Tensor Calculation for Paramagnetic Surface
    States: Hydrogen Adsorption at Si Surfaces.” <i>Physica Status Solidi (c)</i>,
    vol. 7, no. 2, 2010, pp. 157–60, doi:<a href="https://doi.org/10.1002/pssc.200982462">10.1002/pssc.200982462</a>.'
  short: U. Gerstmann, M. Rohrmüller, F. Mauri, W.G. Schmidt, Physica Status Solidi
    (c) 7 (2010) 157–160.
date_created: 2019-10-01T09:20:03Z
date_updated: 2025-12-05T12:45:54Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '790'
- _id: '230'
- _id: '27'
doi: 10.1002/pssc.200982462
intvolume: '         7'
issue: '2'
language:
- iso: eng
page: 157-160
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: physica status solidi (c)
publication_identifier:
  issn:
  - 1862-6351
  - 1610-1642
publication_status: published
status: public
title: 'Ab initiog-tensor calculation for paramagnetic surface states: hydrogen adsorption
  at Si surfaces'
type: journal_article
user_id: '16199'
volume: 7
year: '2010'
...
---
_id: '13839'
author:
- first_name: S.
  full_name: Blankenburg, S.
  last_name: Blankenburg
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: Blankenburg S, Schmidt WG. Temperature dependent stability of self-assembled
    molecular rows. <i>physica status solidi (c)</i>. 2010;7(2):415-417. doi:<a href="https://doi.org/10.1002/pssc.200982460">10.1002/pssc.200982460</a>
  apa: Blankenburg, S., &#38; Schmidt, W. G. (2010). Temperature dependent stability
    of self-assembled molecular rows. <i>Physica Status Solidi (c)</i>, <i>7</i>(2),
    415–417. <a href="https://doi.org/10.1002/pssc.200982460">https://doi.org/10.1002/pssc.200982460</a>
  bibtex: '@article{Blankenburg_Schmidt_2010, title={Temperature dependent stability
    of self-assembled molecular rows}, volume={7}, DOI={<a href="https://doi.org/10.1002/pssc.200982460">10.1002/pssc.200982460</a>},
    number={2}, journal={physica status solidi (c)}, author={Blankenburg, S. and Schmidt,
    Wolf Gero}, year={2010}, pages={415–417} }'
  chicago: 'Blankenburg, S., and Wolf Gero Schmidt. “Temperature Dependent Stability
    of Self-Assembled Molecular Rows.” <i>Physica Status Solidi (c)</i> 7, no. 2 (2010):
    415–17. <a href="https://doi.org/10.1002/pssc.200982460">https://doi.org/10.1002/pssc.200982460</a>.'
  ieee: 'S. Blankenburg and W. G. Schmidt, “Temperature dependent stability of self-assembled
    molecular rows,” <i>physica status solidi (c)</i>, vol. 7, no. 2, pp. 415–417,
    2010, doi: <a href="https://doi.org/10.1002/pssc.200982460">10.1002/pssc.200982460</a>.'
  mla: Blankenburg, S., and Wolf Gero Schmidt. “Temperature Dependent Stability of
    Self-Assembled Molecular Rows.” <i>Physica Status Solidi (c)</i>, vol. 7, no.
    2, 2010, pp. 415–17, doi:<a href="https://doi.org/10.1002/pssc.200982460">10.1002/pssc.200982460</a>.
  short: S. Blankenburg, W.G. Schmidt, Physica Status Solidi (c) 7 (2010) 415–417.
date_created: 2019-10-15T07:47:46Z
date_updated: 2025-12-16T07:36:06Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1002/pssc.200982460
funded_apc: '1'
intvolume: '         7'
issue: '2'
language:
- iso: eng
page: 415-417
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: physica status solidi (c)
publication_identifier:
  issn:
  - 1862-6351
  - 1610-1642
publication_status: published
status: public
title: Temperature dependent stability of self-assembled molecular rows
type: journal_article
user_id: '16199'
volume: 7
year: '2010'
...
---
_id: '13838'
author:
- 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
citation:
  ama: Sanna S, Schmidt WG. GaN growth on LiNbO3 (0001) - a first-principles simulation.
    <i>physica status solidi (c)</i>. 2010;7(7-8):2272-2274. doi:<a href="https://doi.org/10.1002/pssc.200983649">10.1002/pssc.200983649</a>
  apa: Sanna, S., &#38; Schmidt, W. G. (2010). GaN growth on LiNbO3 (0001) - a first-principles
    simulation. <i>Physica Status Solidi (c)</i>, <i>7</i>(7–8), 2272–2274. <a href="https://doi.org/10.1002/pssc.200983649">https://doi.org/10.1002/pssc.200983649</a>
  bibtex: '@article{Sanna_Schmidt_2010, title={GaN growth on LiNbO3 (0001) - a first-principles
    simulation}, volume={7}, DOI={<a href="https://doi.org/10.1002/pssc.200983649">10.1002/pssc.200983649</a>},
    number={7–8}, journal={physica status solidi (c)}, author={Sanna, Simone and Schmidt,
    Wolf Gero}, year={2010}, pages={2272–2274} }'
  chicago: 'Sanna, Simone, and Wolf Gero Schmidt. “GaN Growth on LiNbO3 (0001) - a
    First-Principles Simulation.” <i>Physica Status Solidi (c)</i> 7, no. 7–8 (2010):
    2272–74. <a href="https://doi.org/10.1002/pssc.200983649">https://doi.org/10.1002/pssc.200983649</a>.'
  ieee: 'S. Sanna and W. G. Schmidt, “GaN growth on LiNbO3 (0001) - a first-principles
    simulation,” <i>physica status solidi (c)</i>, vol. 7, no. 7–8, pp. 2272–2274,
    2010, doi: <a href="https://doi.org/10.1002/pssc.200983649">10.1002/pssc.200983649</a>.'
  mla: Sanna, Simone, and Wolf Gero Schmidt. “GaN Growth on LiNbO3 (0001) - a First-Principles
    Simulation.” <i>Physica Status Solidi (c)</i>, vol. 7, no. 7–8, 2010, pp. 2272–74,
    doi:<a href="https://doi.org/10.1002/pssc.200983649">10.1002/pssc.200983649</a>.
  short: S. Sanna, W.G. Schmidt, Physica Status Solidi (c) 7 (2010) 2272–2274.
date_created: 2019-10-15T07:46:44Z
date_updated: 2025-12-16T07:36:34Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1002/pssc.200983649
funded_apc: '1'
intvolume: '         7'
issue: 7-8
language:
- iso: eng
page: 2272-2274
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: physica status solidi (c)
publication_identifier:
  issn:
  - 1862-6351
  - 1610-1642
publication_status: published
status: public
title: GaN growth on LiNbO3 (0001) - a first-principles simulation
type: journal_article
user_id: '16199'
volume: 7
year: '2010'
...
---
_id: '13843'
author:
- 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
- first_name: P.
  full_name: Thissen, P.
  last_name: Thissen
- first_name: Guido
  full_name: Grundmeier, Guido
  id: '194'
  last_name: Grundmeier
citation:
  ama: Wippermann S, Schmidt WG, Thissen P, Grundmeier G. Dissociative and molecular
    adsorption of water onα-Al2O3(0001). <i>physica status solidi (c)</i>. 2010;7(2):137-140.
    doi:<a href="https://doi.org/10.1002/pssc.200982423">10.1002/pssc.200982423</a>
  apa: Wippermann, S., Schmidt, W. G., Thissen, P., &#38; Grundmeier, G. (2010). Dissociative
    and molecular adsorption of water onα-Al2O3(0001). <i>Physica Status Solidi (c)</i>,
    <i>7</i>(2), 137–140. <a href="https://doi.org/10.1002/pssc.200982423">https://doi.org/10.1002/pssc.200982423</a>
  bibtex: '@article{Wippermann_Schmidt_Thissen_Grundmeier_2010, title={Dissociative
    and molecular adsorption of water onα-Al2O3(0001)}, volume={7}, DOI={<a href="https://doi.org/10.1002/pssc.200982423">10.1002/pssc.200982423</a>},
    number={2}, journal={physica status solidi (c)}, author={Wippermann, S. and Schmidt,
    Wolf Gero and Thissen, P. and Grundmeier, Guido}, year={2010}, pages={137–140}
    }'
  chicago: 'Wippermann, S., Wolf Gero Schmidt, P. Thissen, and Guido Grundmeier. “Dissociative
    and Molecular Adsorption of Water Onα-Al2O3(0001).” <i>Physica Status Solidi (c)</i>
    7, no. 2 (2010): 137–40. <a href="https://doi.org/10.1002/pssc.200982423">https://doi.org/10.1002/pssc.200982423</a>.'
  ieee: 'S. Wippermann, W. G. Schmidt, P. Thissen, and G. Grundmeier, “Dissociative
    and molecular adsorption of water onα-Al2O3(0001),” <i>physica status solidi (c)</i>,
    vol. 7, no. 2, pp. 137–140, 2010, doi: <a href="https://doi.org/10.1002/pssc.200982423">10.1002/pssc.200982423</a>.'
  mla: Wippermann, S., et al. “Dissociative and Molecular Adsorption of Water Onα-Al2O3(0001).”
    <i>Physica Status Solidi (c)</i>, vol. 7, no. 2, 2010, pp. 137–40, doi:<a href="https://doi.org/10.1002/pssc.200982423">10.1002/pssc.200982423</a>.
  short: S. Wippermann, W.G. Schmidt, P. Thissen, G. Grundmeier, Physica Status Solidi
    (c) 7 (2010) 137–140.
date_created: 2019-10-15T07:55:59Z
date_updated: 2025-12-16T07:43:16Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '2'
- _id: '302'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1002/pssc.200982423
funded_apc: '1'
intvolume: '         7'
issue: '2'
language:
- iso: eng
page: 137-140
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: physica status solidi (c)
publication_identifier:
  issn:
  - 1862-6351
  - 1610-1642
publication_status: published
status: public
title: Dissociative and molecular adsorption of water onα-Al2O3(0001)
type: journal_article
user_id: '16199'
volume: 7
year: '2010'
...
---
_id: '13842'
author:
- first_name: Simone
  full_name: Sanna, Simone
  last_name: Sanna
- first_name: Alexander V.
  full_name: Gavrilenko, Alexander V.
  last_name: Gavrilenko
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: Sanna S, Gavrilenko AV, Schmidt WG. Ab initio investigation of the LiNbO3(0001)
    surface. <i>physica status solidi (c)</i>. 2010;7(2):145-148. doi:<a href="https://doi.org/10.1002/pssc.200982456">10.1002/pssc.200982456</a>
  apa: Sanna, S., Gavrilenko, A. V., &#38; Schmidt, W. G. (2010). Ab initio investigation
    of the LiNbO3(0001) surface. <i>Physica Status Solidi (c)</i>, <i>7</i>(2), 145–148.
    <a href="https://doi.org/10.1002/pssc.200982456">https://doi.org/10.1002/pssc.200982456</a>
  bibtex: '@article{Sanna_Gavrilenko_Schmidt_2010, title={Ab initio investigation
    of the LiNbO3(0001) surface}, volume={7}, DOI={<a href="https://doi.org/10.1002/pssc.200982456">10.1002/pssc.200982456</a>},
    number={2}, journal={physica status solidi (c)}, author={Sanna, Simone and Gavrilenko,
    Alexander V. and Schmidt, Wolf Gero}, year={2010}, pages={145–148} }'
  chicago: 'Sanna, Simone, Alexander V. Gavrilenko, and Wolf Gero Schmidt. “Ab Initio
    Investigation of the LiNbO3(0001) Surface.” <i>Physica Status Solidi (c)</i> 7,
    no. 2 (2010): 145–48. <a href="https://doi.org/10.1002/pssc.200982456">https://doi.org/10.1002/pssc.200982456</a>.'
  ieee: 'S. Sanna, A. V. Gavrilenko, and W. G. Schmidt, “Ab initio investigation of
    the LiNbO3(0001) surface,” <i>physica status solidi (c)</i>, vol. 7, no. 2, pp.
    145–148, 2010, doi: <a href="https://doi.org/10.1002/pssc.200982456">10.1002/pssc.200982456</a>.'
  mla: Sanna, Simone, et al. “Ab Initio Investigation of the LiNbO3(0001) Surface.”
    <i>Physica Status Solidi (c)</i>, vol. 7, no. 2, 2010, pp. 145–48, doi:<a href="https://doi.org/10.1002/pssc.200982456">10.1002/pssc.200982456</a>.
  short: S. Sanna, A.V. Gavrilenko, W.G. Schmidt, Physica Status Solidi (c) 7 (2010)
    145–148.
date_created: 2019-10-15T07:51:08Z
date_updated: 2025-12-16T07:43:40Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1002/pssc.200982456
funded_apc: '1'
intvolume: '         7'
issue: '2'
language:
- iso: eng
page: 145-148
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: physica status solidi (c)
publication_identifier:
  issn:
  - 1862-6351
  - 1610-1642
publication_status: published
status: public
title: Ab initio investigation of the LiNbO3(0001) surface
type: journal_article
user_id: '16199'
volume: 7
year: '2010'
...
---
_id: '13841'
author:
- first_name: S.
  full_name: Blankenburg, S.
  last_name: Blankenburg
- first_name: E.
  full_name: Rauls, E.
  last_name: Rauls
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: Blankenburg S, Rauls E, Schmidt WG. The physics of highly ordered molecular
    rows. <i>physica status solidi (c)</i>. 2010;7(2):153-156. doi:<a href="https://doi.org/10.1002/pssc.200982459">10.1002/pssc.200982459</a>
  apa: Blankenburg, S., Rauls, E., &#38; Schmidt, W. G. (2010). The physics of highly
    ordered molecular rows. <i>Physica Status Solidi (c)</i>, <i>7</i>(2), 153–156.
    <a href="https://doi.org/10.1002/pssc.200982459">https://doi.org/10.1002/pssc.200982459</a>
  bibtex: '@article{Blankenburg_Rauls_Schmidt_2010, title={The physics of highly ordered
    molecular rows}, volume={7}, DOI={<a href="https://doi.org/10.1002/pssc.200982459">10.1002/pssc.200982459</a>},
    number={2}, journal={physica status solidi (c)}, author={Blankenburg, S. and Rauls,
    E. and Schmidt, Wolf Gero}, year={2010}, pages={153–156} }'
  chicago: 'Blankenburg, S., E. Rauls, and Wolf Gero Schmidt. “The Physics of Highly
    Ordered Molecular Rows.” <i>Physica Status Solidi (c)</i> 7, no. 2 (2010): 153–56.
    <a href="https://doi.org/10.1002/pssc.200982459">https://doi.org/10.1002/pssc.200982459</a>.'
  ieee: 'S. Blankenburg, E. Rauls, and W. G. Schmidt, “The physics of highly ordered
    molecular rows,” <i>physica status solidi (c)</i>, vol. 7, no. 2, pp. 153–156,
    2010, doi: <a href="https://doi.org/10.1002/pssc.200982459">10.1002/pssc.200982459</a>.'
  mla: Blankenburg, S., et al. “The Physics of Highly Ordered Molecular Rows.” <i>Physica
    Status Solidi (c)</i>, vol. 7, no. 2, 2010, pp. 153–56, doi:<a href="https://doi.org/10.1002/pssc.200982459">10.1002/pssc.200982459</a>.
  short: S. Blankenburg, E. Rauls, W.G. Schmidt, Physica Status Solidi (c) 7 (2010)
    153–156.
date_created: 2019-10-15T07:49:59Z
date_updated: 2025-12-16T07:44:07Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1002/pssc.200982459
funded_apc: '1'
intvolume: '         7'
issue: '2'
language:
- iso: eng
page: 153-156
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: physica status solidi (c)
publication_identifier:
  issn:
  - 1862-6351
  - 1610-1642
publication_status: published
status: public
title: The physics of highly ordered molecular rows
type: journal_article
user_id: '16199'
volume: 7
year: '2010'
...
---
_id: '18562'
abstract:
- lang: eng
  text: "The structural and electronic properties of strained silicon are investigated
    quantitatively with ab initio computational methods. For this purpose we combine
    densityfunctional theory within the local‐density approximation and the GW approximation
    for the electronic self‐energy. From the variation of the total energy as a function
    of applied strain we obtain the elastic constants, Poisson ratios and related
    structural parameters, taking a possible internal relaxation fully into account.
    For biaxial tensile strain in the (001) and (111) planes we then investigate the
    effects on the electronic band structure. These strain configurations occur in
    epitaxial silicon films grown on SiGe templates along different crystallographic
    directions.\r\nThe tetragonal deformation resulting from (001) strain induces
    a valley splitting that removes the sixfold degeneracy of the conduction‐band
    minimum. Furthermore, strain in any direction causes the band structure to warp.
    We present quantitative results for the electron effective mass, derived from
    the curvature of the conduction band, as a function of strain and discuss the
    implications for the mobility of the charge carriers. The inclusion of proper
    self‐energy corrections within the GW approximation in our work not only yields
    band gaps in much better agreement with experimental measurements than the localdensity
    approximation, but also predicts slightly larger electron effective masses."
article_type: original
author:
- first_name: Mohammed
  full_name: Bouhassoune, Mohammed
  last_name: Bouhassoune
- first_name: Arno
  full_name: Schindlmayr, Arno
  id: '458'
  last_name: Schindlmayr
  orcid: 0000-0002-4855-071X
citation:
  ama: Bouhassoune M, Schindlmayr A. Electronic structure and effective masses in
    strained silicon. <i>Physica Status Solidi C</i>. 2010;7(2):460-463. doi:<a href="https://doi.org/10.1002/pssc.200982470">10.1002/pssc.200982470</a>
  apa: Bouhassoune, M., &#38; Schindlmayr, A. (2010). Electronic structure and effective
    masses in strained silicon. <i>Physica Status Solidi C</i>, <i>7</i>(2), 460–463.
    <a href="https://doi.org/10.1002/pssc.200982470">https://doi.org/10.1002/pssc.200982470</a>
  bibtex: '@article{Bouhassoune_Schindlmayr_2010, title={Electronic structure and
    effective masses in strained silicon}, volume={7}, DOI={<a href="https://doi.org/10.1002/pssc.200982470">10.1002/pssc.200982470</a>},
    number={2}, journal={Physica Status Solidi C}, publisher={Wiley-VCH}, author={Bouhassoune,
    Mohammed and Schindlmayr, Arno}, year={2010}, pages={460–463} }'
  chicago: 'Bouhassoune, Mohammed, and Arno Schindlmayr. “Electronic Structure and
    Effective Masses in Strained Silicon.” <i>Physica Status Solidi C</i> 7, no. 2
    (2010): 460–63. <a href="https://doi.org/10.1002/pssc.200982470">https://doi.org/10.1002/pssc.200982470</a>.'
  ieee: 'M. Bouhassoune and A. Schindlmayr, “Electronic structure and effective masses
    in strained silicon,” <i>Physica Status Solidi C</i>, vol. 7, no. 2, pp. 460–463,
    2010, doi: <a href="https://doi.org/10.1002/pssc.200982470">10.1002/pssc.200982470</a>.'
  mla: Bouhassoune, Mohammed, and Arno Schindlmayr. “Electronic Structure and Effective
    Masses in Strained Silicon.” <i>Physica Status Solidi C</i>, vol. 7, no. 2, Wiley-VCH,
    2010, pp. 460–63, doi:<a href="https://doi.org/10.1002/pssc.200982470">10.1002/pssc.200982470</a>.
  short: M. Bouhassoune, A. Schindlmayr, Physica Status Solidi C 7 (2010) 460–463.
conference:
  end_date: 2009-07-10
  location: Weimar
  name: 12th International Conference on the Formation of Semiconductor Interfaces
  start_date: 2009-07-05
date_created: 2020-08-28T11:35:38Z
date_updated: 2025-12-16T08:10:05Z
ddc:
- '530'
department:
- _id: '296'
- _id: '35'
- _id: '15'
- _id: '170'
- _id: '230'
doi: 10.1002/pssc.200982470
external_id:
  isi:
  - '000284313000081'
file:
- access_level: closed
  content_type: application/pdf
  creator: schindlm
  date_created: 2020-08-28T14:38:30Z
  date_updated: 2020-08-30T15:13:32Z
  description: © 2010 WILEY‐VCH Verlag GmbH & Co. KGaA, Weinheim
  file_id: '18582'
  file_name: pssc.200982470.pdf
  file_size: 118792
  relation: main_file
  title: Electronic structure and effective masses in strained silicon
file_date_updated: 2020-08-30T15:13:32Z
has_accepted_license: '1'
intvolume: '         7'
isi: '1'
issue: '2'
language:
- iso: eng
page: 460-463
publication: Physica Status Solidi C
publication_identifier:
  eissn:
  - 1610-1642
  issn:
  - 1862-6351
publication_status: published
publisher: Wiley-VCH
quality_controlled: '1'
status: public
title: Electronic structure and effective masses in strained silicon
type: journal_article
user_id: '16199'
volume: 7
year: '2010'
...
---
_id: '4196'
abstract:
- lang: eng
  text: The growth of cubic group III-nitrides is a direct way to eliminate polarization
    effects, which inherently limit the fabrication of normally-off heterojunction
    field-effect transistors (HFETs) in GaN technology. HFET structures were fabricated
    of non-polar cubic AlGaN/GaN hetero layers grown by plasma assisted molecular
    beam epitaxy (MBE) on free standing 3C-SiC (001). The electrical insulation of
    3C-SiC was realised by Ar+ implantation before c-AlGaN/GaN MBE. The structural
    properties of the epilayers were studied by highresolution x-ray diffraction (HRXRD).
    HFETs with normally off and normally-on characteristics were fabricated of cubic
    AlGaN/GaN. Capacitance-voltage (CV) characteristics of thegate contact were performed
    to detect the electron channel at the c-AlGaN/GaN hetero interface.
article_type: original
author:
- first_name: Elena
  full_name: Tschumak, Elena
  last_name: Tschumak
- first_name: Jörg
  full_name: Lindner, Jörg
  id: '20797'
  last_name: Lindner
- first_name: M.
  full_name: Bürger, M.
  last_name: Bürger
- first_name: K.
  full_name: Lischka, K.
  last_name: Lischka
- first_name: H.
  full_name: Nagasawa, H.
  last_name: Nagasawa
- first_name: M.
  full_name: Abe, M.
  last_name: Abe
- first_name: Donald
  full_name: As, Donald
  last_name: As
citation:
  ama: Tschumak E, Lindner J, Bürger M, et al. Non-polar cubic AlGaN/GaN HFETs grown
    by MBE on Ar+implanted 3C-SiC (001). <i>physica status solidi (c)</i>. 2009;7(1):104-107.
    doi:<a href="https://doi.org/10.1002/pssc.200982615">10.1002/pssc.200982615</a>
  apa: Tschumak, E., Lindner, J., Bürger, M., Lischka, K., Nagasawa, H., Abe, M.,
    &#38; As, D. (2009). Non-polar cubic AlGaN/GaN HFETs grown by MBE on Ar+implanted
    3C-SiC (001). <i>Physica Status Solidi (C)</i>, <i>7</i>(1), 104–107. <a href="https://doi.org/10.1002/pssc.200982615">https://doi.org/10.1002/pssc.200982615</a>
  bibtex: '@article{Tschumak_Lindner_Bürger_Lischka_Nagasawa_Abe_As_2009, title={Non-polar
    cubic AlGaN/GaN HFETs grown by MBE on Ar+implanted 3C-SiC (001)}, volume={7},
    DOI={<a href="https://doi.org/10.1002/pssc.200982615">10.1002/pssc.200982615</a>},
    number={1}, journal={physica status solidi (c)}, publisher={Wiley}, author={Tschumak,
    Elena and Lindner, Jörg and Bürger, M. and Lischka, K. and Nagasawa, H. and Abe,
    M. and As, Donald}, year={2009}, pages={104–107} }'
  chicago: 'Tschumak, Elena, Jörg Lindner, M. Bürger, K. Lischka, H. Nagasawa, M.
    Abe, and Donald As. “Non-Polar Cubic AlGaN/GaN HFETs Grown by MBE on Ar+implanted
    3C-SiC (001).” <i>Physica Status Solidi (C)</i> 7, no. 1 (2009): 104–7. <a href="https://doi.org/10.1002/pssc.200982615">https://doi.org/10.1002/pssc.200982615</a>.'
  ieee: E. Tschumak <i>et al.</i>, “Non-polar cubic AlGaN/GaN HFETs grown by MBE on
    Ar+implanted 3C-SiC (001),” <i>physica status solidi (c)</i>, vol. 7, no. 1, pp.
    104–107, 2009.
  mla: Tschumak, Elena, et al. “Non-Polar Cubic AlGaN/GaN HFETs Grown by MBE on Ar+implanted
    3C-SiC (001).” <i>Physica Status Solidi (C)</i>, vol. 7, no. 1, Wiley, 2009, pp.
    104–07, doi:<a href="https://doi.org/10.1002/pssc.200982615">10.1002/pssc.200982615</a>.
  short: E. Tschumak, J. Lindner, M. Bürger, K. Lischka, H. Nagasawa, M. Abe, D. As,
    Physica Status Solidi (C) 7 (2009) 104–107.
date_created: 2018-08-28T12:15:20Z
date_updated: 2022-01-06T07:00:33Z
ddc:
- '530'
department:
- _id: '15'
- _id: '286'
doi: 10.1002/pssc.200982615
file:
- access_level: closed
  content_type: application/pdf
  creator: hclaudia
  date_created: 2018-08-28T12:16:11Z
  date_updated: 2018-08-28T12:16:11Z
  file_id: '4197'
  file_name: Nonpolar cubic AlGaN-GaN HFETs grown by MBE on Ar+ implanted 3C SiC (001).pdf
  file_size: 213837
  relation: main_file
  success: 1
file_date_updated: 2018-08-28T12:16:11Z
has_accepted_license: '1'
intvolume: '         7'
issue: '1'
language:
- iso: eng
page: 104-107
publication: physica status solidi (c)
publication_identifier:
  issn:
  - 1862-6351
  - 1610-1642
publication_status: published
publisher: Wiley
status: public
title: Non-polar cubic AlGaN/GaN HFETs grown by MBE on Ar+implanted 3C-SiC (001)
type: journal_article
user_id: '55706'
volume: 7
year: '2009'
...
---
_id: '13580'
author:
- 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
- first_name: P.
  full_name: Thissen, P.
  last_name: Thissen
- first_name: Guido
  full_name: Grundmeier, Guido
  id: '194'
  last_name: Grundmeier
citation:
  ama: Wippermann S, Schmidt WG, Thissen P, Grundmeier G. Dissociative and molecular
    adsorption of water onα-Al2O3(0001). <i>physica status solidi (c)</i>. 2009;7(2):137-140.
    doi:<a href="https://doi.org/10.1002/pssc.200982423">10.1002/pssc.200982423</a>
  apa: Wippermann, S., Schmidt, W. G., Thissen, P., &#38; Grundmeier, G. (2009). Dissociative
    and molecular adsorption of water onα-Al2O3(0001). <i>Physica Status Solidi (c)</i>,
    <i>7</i>(2), 137–140. <a href="https://doi.org/10.1002/pssc.200982423">https://doi.org/10.1002/pssc.200982423</a>
  bibtex: '@article{Wippermann_Schmidt_Thissen_Grundmeier_2009, title={Dissociative
    and molecular adsorption of water onα-Al2O3(0001)}, volume={7}, DOI={<a href="https://doi.org/10.1002/pssc.200982423">10.1002/pssc.200982423</a>},
    number={2}, journal={physica status solidi (c)}, author={Wippermann, S. and Schmidt,
    Wolf Gero and Thissen, P. and Grundmeier, Guido}, year={2009}, pages={137–140}
    }'
  chicago: 'Wippermann, S., Wolf Gero Schmidt, P. Thissen, and Guido Grundmeier. “Dissociative
    and Molecular Adsorption of Water Onα-Al2O3(0001).” <i>Physica Status Solidi (c)</i>
    7, no. 2 (2009): 137–40. <a href="https://doi.org/10.1002/pssc.200982423">https://doi.org/10.1002/pssc.200982423</a>.'
  ieee: 'S. Wippermann, W. G. Schmidt, P. Thissen, and G. Grundmeier, “Dissociative
    and molecular adsorption of water onα-Al2O3(0001),” <i>physica status solidi (c)</i>,
    vol. 7, no. 2, pp. 137–140, 2009, doi: <a href="https://doi.org/10.1002/pssc.200982423">10.1002/pssc.200982423</a>.'
  mla: Wippermann, S., et al. “Dissociative and Molecular Adsorption of Water Onα-Al2O3(0001).”
    <i>Physica Status Solidi (c)</i>, vol. 7, no. 2, 2009, pp. 137–40, doi:<a href="https://doi.org/10.1002/pssc.200982423">10.1002/pssc.200982423</a>.
  short: S. Wippermann, W.G. Schmidt, P. Thissen, G. Grundmeier, Physica Status Solidi
    (c) 7 (2009) 137–140.
date_created: 2019-10-01T14:32:47Z
date_updated: 2025-12-05T10:51:06Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '2'
- _id: '302'
- _id: '35'
- _id: '27'
- _id: '230'
doi: 10.1002/pssc.200982423
intvolume: '         7'
issue: '2'
language:
- iso: eng
page: 137-140
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: physica status solidi (c)
publication_identifier:
  issn:
  - 1862-6351
  - 1610-1642
publication_status: published
status: public
title: Dissociative and molecular adsorption of water onα-Al2O3(0001)
type: journal_article
user_id: '16199'
volume: 7
year: '2009'
...
---
_id: '13579'
author:
- first_name: Simone
  full_name: Sanna, Simone
  last_name: Sanna
- first_name: Alexander V.
  full_name: Gavrilenko, Alexander V.
  last_name: Gavrilenko
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: Sanna S, Gavrilenko AV, Schmidt WG. Ab initioinvestigation of the LiNbO3(0001)
    surface. <i>physica status solidi (c)</i>. 2009;7(2):145-148. doi:<a href="https://doi.org/10.1002/pssc.200982456">10.1002/pssc.200982456</a>
  apa: Sanna, S., Gavrilenko, A. V., &#38; Schmidt, W. G. (2009). Ab initioinvestigation
    of the LiNbO3(0001) surface. <i>Physica Status Solidi (c)</i>, <i>7</i>(2), 145–148.
    <a href="https://doi.org/10.1002/pssc.200982456">https://doi.org/10.1002/pssc.200982456</a>
  bibtex: '@article{Sanna_Gavrilenko_Schmidt_2009, title={Ab initioinvestigation of
    the LiNbO3(0001) surface}, volume={7}, DOI={<a href="https://doi.org/10.1002/pssc.200982456">10.1002/pssc.200982456</a>},
    number={2}, journal={physica status solidi (c)}, author={Sanna, Simone and Gavrilenko,
    Alexander V. and Schmidt, Wolf Gero}, year={2009}, pages={145–148} }'
  chicago: 'Sanna, Simone, Alexander V. Gavrilenko, and Wolf Gero Schmidt. “Ab Initioinvestigation
    of the LiNbO3(0001) Surface.” <i>Physica Status Solidi (c)</i> 7, no. 2 (2009):
    145–48. <a href="https://doi.org/10.1002/pssc.200982456">https://doi.org/10.1002/pssc.200982456</a>.'
  ieee: 'S. Sanna, A. V. Gavrilenko, and W. G. Schmidt, “Ab initioinvestigation of
    the LiNbO3(0001) surface,” <i>physica status solidi (c)</i>, vol. 7, no. 2, pp.
    145–148, 2009, doi: <a href="https://doi.org/10.1002/pssc.200982456">10.1002/pssc.200982456</a>.'
  mla: Sanna, Simone, et al. “Ab Initioinvestigation of the LiNbO3(0001) Surface.”
    <i>Physica Status Solidi (c)</i>, vol. 7, no. 2, 2009, pp. 145–48, doi:<a href="https://doi.org/10.1002/pssc.200982456">10.1002/pssc.200982456</a>.
  short: S. Sanna, A.V. Gavrilenko, W.G. Schmidt, Physica Status Solidi (c) 7 (2009)
    145–148.
date_created: 2019-10-01T14:31:26Z
date_updated: 2025-12-05T10:52:38Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1002/pssc.200982456
intvolume: '         7'
issue: '2'
language:
- iso: eng
page: 145-148
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: physica status solidi (c)
publication_identifier:
  issn:
  - 1862-6351
  - 1610-1642
publication_status: published
status: public
title: Ab initioinvestigation of the LiNbO3(0001) surface
type: journal_article
user_id: '16199'
volume: 7
year: '2009'
...
---
_id: '13577'
author:
- first_name: S.
  full_name: Blankenburg, S.
  last_name: Blankenburg
- first_name: E.
  full_name: Rauls, E.
  last_name: Rauls
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: Blankenburg S, Rauls E, Schmidt WG. The physics of highly ordered molecular
    rows. <i>physica status solidi (c)</i>. 2009;7(2):153-156. doi:<a href="https://doi.org/10.1002/pssc.200982459">10.1002/pssc.200982459</a>
  apa: Blankenburg, S., Rauls, E., &#38; Schmidt, W. G. (2009). The physics of highly
    ordered molecular rows. <i>Physica Status Solidi (c)</i>, <i>7</i>(2), 153–156.
    <a href="https://doi.org/10.1002/pssc.200982459">https://doi.org/10.1002/pssc.200982459</a>
  bibtex: '@article{Blankenburg_Rauls_Schmidt_2009, title={The physics of highly ordered
    molecular rows}, volume={7}, DOI={<a href="https://doi.org/10.1002/pssc.200982459">10.1002/pssc.200982459</a>},
    number={2}, journal={physica status solidi (c)}, author={Blankenburg, S. and Rauls,
    E. and Schmidt, Wolf Gero}, year={2009}, pages={153–156} }'
  chicago: 'Blankenburg, S., E. Rauls, and Wolf Gero Schmidt. “The Physics of Highly
    Ordered Molecular Rows.” <i>Physica Status Solidi (c)</i> 7, no. 2 (2009): 153–56.
    <a href="https://doi.org/10.1002/pssc.200982459">https://doi.org/10.1002/pssc.200982459</a>.'
  ieee: 'S. Blankenburg, E. Rauls, and W. G. Schmidt, “The physics of highly ordered
    molecular rows,” <i>physica status solidi (c)</i>, vol. 7, no. 2, pp. 153–156,
    2009, doi: <a href="https://doi.org/10.1002/pssc.200982459">10.1002/pssc.200982459</a>.'
  mla: Blankenburg, S., et al. “The Physics of Highly Ordered Molecular Rows.” <i>Physica
    Status Solidi (c)</i>, vol. 7, no. 2, 2009, pp. 153–56, doi:<a href="https://doi.org/10.1002/pssc.200982459">10.1002/pssc.200982459</a>.
  short: S. Blankenburg, E. Rauls, W.G. Schmidt, Physica Status Solidi (c) 7 (2009)
    153–156.
date_created: 2019-10-01T14:29:12Z
date_updated: 2025-12-05T12:44:43Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1002/pssc.200982459
intvolume: '         7'
issue: '2'
language:
- iso: eng
page: 153-156
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: physica status solidi (c)
publication_identifier:
  issn:
  - 1862-6351
  - 1610-1642
publication_status: published
status: public
title: The physics of highly ordered molecular rows
type: journal_article
user_id: '16199'
volume: 7
year: '2009'
...
---
_id: '13578'
author:
- first_name: Simone
  full_name: Sanna, Simone
  last_name: Sanna
- first_name: Alexander V.
  full_name: Gavrilenko, Alexander V.
  last_name: Gavrilenko
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: Sanna S, Gavrilenko AV, Schmidt WG. Ab initioinvestigation of the LiNbO3(0001)
    surface. <i>physica status solidi (c)</i>. Published online 2009:145-148. doi:<a
    href="https://doi.org/10.1002/pssc.200982456">10.1002/pssc.200982456</a>
  apa: Sanna, S., Gavrilenko, A. V., &#38; Schmidt, W. G. (2009). Ab initioinvestigation
    of the LiNbO3(0001) surface. <i>Physica Status Solidi (c)</i>, 145–148. <a href="https://doi.org/10.1002/pssc.200982456">https://doi.org/10.1002/pssc.200982456</a>
  bibtex: '@article{Sanna_Gavrilenko_Schmidt_2009, title={Ab initioinvestigation of
    the LiNbO3(0001) surface}, DOI={<a href="https://doi.org/10.1002/pssc.200982456">10.1002/pssc.200982456</a>},
    journal={physica status solidi (c)}, author={Sanna, Simone and Gavrilenko, Alexander
    V. and Schmidt, Wolf Gero}, year={2009}, pages={145–148} }'
  chicago: Sanna, Simone, Alexander V. Gavrilenko, and Wolf Gero Schmidt. “Ab Initioinvestigation
    of the LiNbO3(0001) Surface.” <i>Physica Status Solidi (c)</i>, 2009, 145–48.
    <a href="https://doi.org/10.1002/pssc.200982456">https://doi.org/10.1002/pssc.200982456</a>.
  ieee: 'S. Sanna, A. V. Gavrilenko, and W. G. Schmidt, “Ab initioinvestigation of
    the LiNbO3(0001) surface,” <i>physica status solidi (c)</i>, pp. 145–148, 2009,
    doi: <a href="https://doi.org/10.1002/pssc.200982456">10.1002/pssc.200982456</a>.'
  mla: Sanna, Simone, et al. “Ab Initioinvestigation of the LiNbO3(0001) Surface.”
    <i>Physica Status Solidi (c)</i>, 2009, pp. 145–48, doi:<a href="https://doi.org/10.1002/pssc.200982456">10.1002/pssc.200982456</a>.
  short: S. Sanna, A.V. Gavrilenko, W.G. Schmidt, Physica Status Solidi (c) (2009)
    145–148.
date_created: 2019-10-01T14:31:18Z
date_updated: 2025-12-05T12:44:17Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1002/pssc.200982456
language:
- iso: eng
page: 145-148
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: physica status solidi (c)
publication_identifier:
  issn:
  - 1862-6351
  - 1610-1642
publication_status: published
status: public
title: Ab initioinvestigation of the LiNbO3(0001) surface
type: journal_article
user_id: '16199'
year: '2009'
...
---
_id: '13576'
author:
- first_name: S.
  full_name: Blankenburg, S.
  last_name: Blankenburg
- first_name: E.
  full_name: Rauls, E.
  last_name: Rauls
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: Blankenburg S, Rauls E, Schmidt WG. The physics of highly ordered molecular
    rows. <i>physica status solidi (c)</i>. Published online 2009:153-156. doi:<a
    href="https://doi.org/10.1002/pssc.200982459">10.1002/pssc.200982459</a>
  apa: Blankenburg, S., Rauls, E., &#38; Schmidt, W. G. (2009). The physics of highly
    ordered molecular rows. <i>Physica Status Solidi (c)</i>, 153–156. <a href="https://doi.org/10.1002/pssc.200982459">https://doi.org/10.1002/pssc.200982459</a>
  bibtex: '@article{Blankenburg_Rauls_Schmidt_2009, title={The physics of highly ordered
    molecular rows}, DOI={<a href="https://doi.org/10.1002/pssc.200982459">10.1002/pssc.200982459</a>},
    journal={physica status solidi (c)}, author={Blankenburg, S. and Rauls, E. and
    Schmidt, Wolf Gero}, year={2009}, pages={153–156} }'
  chicago: Blankenburg, S., E. Rauls, and Wolf Gero Schmidt. “The Physics of Highly
    Ordered Molecular Rows.” <i>Physica Status Solidi (c)</i>, 2009, 153–56. <a href="https://doi.org/10.1002/pssc.200982459">https://doi.org/10.1002/pssc.200982459</a>.
  ieee: 'S. Blankenburg, E. Rauls, and W. G. Schmidt, “The physics of highly ordered
    molecular rows,” <i>physica status solidi (c)</i>, pp. 153–156, 2009, doi: <a
    href="https://doi.org/10.1002/pssc.200982459">10.1002/pssc.200982459</a>.'
  mla: Blankenburg, S., et al. “The Physics of Highly Ordered Molecular Rows.” <i>Physica
    Status Solidi (c)</i>, 2009, pp. 153–56, doi:<a href="https://doi.org/10.1002/pssc.200982459">10.1002/pssc.200982459</a>.
  short: S. Blankenburg, E. Rauls, W.G. Schmidt, Physica Status Solidi (c) (2009)
    153–156.
date_created: 2019-10-01T14:28:30Z
date_updated: 2025-12-05T12:44:54Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
doi: 10.1002/pssc.200982459
language:
- iso: eng
page: 153-156
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: physica status solidi (c)
publication_identifier:
  issn:
  - 1862-6351
  - 1610-1642
publication_status: published
status: public
title: The physics of highly ordered molecular rows
type: journal_article
user_id: '16199'
year: '2009'
...