---
_id: '13701'
author:
- first_name: F.
  full_name: Fuchs, F.
  last_name: Fuchs
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: F.
  full_name: Bechstedt, F.
  last_name: Bechstedt
citation:
  ama: Fuchs F, Schmidt WG, Bechstedt F. Initial Stage of Si(001) Surface Oxidation
    from First-Principles Calculations. <i>The Journal of Physical Chemistry B</i>.
    2005;109:17649-17653. doi:<a href="https://doi.org/10.1021/jp0501087">10.1021/jp0501087</a>
  apa: Fuchs, F., Schmidt, W. G., &#38; Bechstedt, F. (2005). Initial Stage of Si(001)
    Surface Oxidation from First-Principles Calculations. <i>The Journal of Physical
    Chemistry B</i>, <i>109</i>, 17649–17653. <a href="https://doi.org/10.1021/jp0501087">https://doi.org/10.1021/jp0501087</a>
  bibtex: '@article{Fuchs_Schmidt_Bechstedt_2005, title={Initial Stage of Si(001)
    Surface Oxidation from First-Principles Calculations}, volume={109}, DOI={<a href="https://doi.org/10.1021/jp0501087">10.1021/jp0501087</a>},
    journal={The Journal of Physical Chemistry B}, author={Fuchs, F. and Schmidt,
    Wolf Gero and Bechstedt, F.}, year={2005}, pages={17649–17653} }'
  chicago: 'Fuchs, F., Wolf Gero Schmidt, and F. Bechstedt. “Initial Stage of Si(001)
    Surface Oxidation from First-Principles Calculations.” <i>The Journal of Physical
    Chemistry B</i> 109 (2005): 17649–53. <a href="https://doi.org/10.1021/jp0501087">https://doi.org/10.1021/jp0501087</a>.'
  ieee: 'F. Fuchs, W. G. Schmidt, and F. Bechstedt, “Initial Stage of Si(001) Surface
    Oxidation from First-Principles Calculations,” <i>The Journal of Physical Chemistry
    B</i>, vol. 109, pp. 17649–17653, 2005, doi: <a href="https://doi.org/10.1021/jp0501087">10.1021/jp0501087</a>.'
  mla: Fuchs, F., et al. “Initial Stage of Si(001) Surface Oxidation from First-Principles
    Calculations.” <i>The Journal of Physical Chemistry B</i>, vol. 109, 2005, pp.
    17649–53, doi:<a href="https://doi.org/10.1021/jp0501087">10.1021/jp0501087</a>.
  short: F. Fuchs, W.G. Schmidt, F. Bechstedt, The Journal of Physical Chemistry B
    109 (2005) 17649–17653.
date_created: 2019-10-09T11:41:59Z
date_updated: 2025-12-05T13:20:42Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
doi: 10.1021/jp0501087
intvolume: '       109'
language:
- iso: eng
page: 17649-17653
publication: The Journal of Physical Chemistry B
publication_identifier:
  issn:
  - 1520-6106
  - 1520-5207
publication_status: published
status: public
title: Initial Stage of Si(001) Surface Oxidation from First-Principles Calculations
type: journal_article
user_id: '16199'
volume: 109
year: '2005'
...
---
_id: '13697'
author:
- first_name: F.
  full_name: Ortmann, F.
  last_name: Ortmann
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: F.
  full_name: Bechstedt, F.
  last_name: Bechstedt
citation:
  ama: 'Ortmann F, Schmidt WG, Bechstedt F. Attracted by Long-Range Electron Correlation:
    Adenine on Graphite. <i>Physical Review Letters</i>. 2005;95(18). doi:<a href="https://doi.org/10.1103/physrevlett.95.186101">10.1103/physrevlett.95.186101</a>'
  apa: 'Ortmann, F., Schmidt, W. G., &#38; Bechstedt, F. (2005). Attracted by Long-Range
    Electron Correlation: Adenine on Graphite. <i>Physical Review Letters</i>, <i>95</i>(18).
    <a href="https://doi.org/10.1103/physrevlett.95.186101">https://doi.org/10.1103/physrevlett.95.186101</a>'
  bibtex: '@article{Ortmann_Schmidt_Bechstedt_2005, title={Attracted by Long-Range
    Electron Correlation: Adenine on Graphite}, volume={95}, DOI={<a href="https://doi.org/10.1103/physrevlett.95.186101">10.1103/physrevlett.95.186101</a>},
    number={18}, journal={Physical Review Letters}, author={Ortmann, F. and Schmidt,
    Wolf Gero and Bechstedt, F.}, year={2005} }'
  chicago: 'Ortmann, F., Wolf Gero Schmidt, and F. Bechstedt. “Attracted by Long-Range
    Electron Correlation: Adenine on Graphite.” <i>Physical Review Letters</i> 95,
    no. 18 (2005). <a href="https://doi.org/10.1103/physrevlett.95.186101">https://doi.org/10.1103/physrevlett.95.186101</a>.'
  ieee: 'F. Ortmann, W. G. Schmidt, and F. Bechstedt, “Attracted by Long-Range Electron
    Correlation: Adenine on Graphite,” <i>Physical Review Letters</i>, vol. 95, no.
    18, 2005, doi: <a href="https://doi.org/10.1103/physrevlett.95.186101">10.1103/physrevlett.95.186101</a>.'
  mla: 'Ortmann, F., et al. “Attracted by Long-Range Electron Correlation: Adenine
    on Graphite.” <i>Physical Review Letters</i>, vol. 95, no. 18, 2005, doi:<a href="https://doi.org/10.1103/physrevlett.95.186101">10.1103/physrevlett.95.186101</a>.'
  short: F. Ortmann, W.G. Schmidt, F. Bechstedt, Physical Review Letters 95 (2005).
date_created: 2019-10-09T11:28:08Z
date_updated: 2025-12-05T13:20:00Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
doi: 10.1103/physrevlett.95.186101
intvolume: '        95'
issue: '18'
language:
- iso: eng
publication: Physical Review Letters
publication_identifier:
  issn:
  - 0031-9007
  - 1079-7114
publication_status: published
status: public
title: 'Attracted by Long-Range Electron Correlation: Adenine on Graphite'
type: journal_article
user_id: '16199'
volume: 95
year: '2005'
...
---
_id: '13702'
author:
- first_name: F.
  full_name: Fuchs, F.
  last_name: Fuchs
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: F.
  full_name: Bechstedt, F.
  last_name: Bechstedt
citation:
  ama: Fuchs F, Schmidt WG, Bechstedt F. Understanding the optical anisotropy of oxidized
    Si(001) surfaces. <i>Physical Review B</i>. 2005;72(7). doi:<a href="https://doi.org/10.1103/physrevb.72.075353">10.1103/physrevb.72.075353</a>
  apa: Fuchs, F., Schmidt, W. G., &#38; Bechstedt, F. (2005). Understanding the optical
    anisotropy of oxidized Si(001) surfaces. <i>Physical Review B</i>, <i>72</i>(7).
    <a href="https://doi.org/10.1103/physrevb.72.075353">https://doi.org/10.1103/physrevb.72.075353</a>
  bibtex: '@article{Fuchs_Schmidt_Bechstedt_2005, title={Understanding the optical
    anisotropy of oxidized Si(001) surfaces}, volume={72}, DOI={<a href="https://doi.org/10.1103/physrevb.72.075353">10.1103/physrevb.72.075353</a>},
    number={7}, journal={Physical Review B}, author={Fuchs, F. and Schmidt, Wolf Gero
    and Bechstedt, F.}, year={2005} }'
  chicago: Fuchs, F., Wolf Gero Schmidt, and F. Bechstedt. “Understanding the Optical
    Anisotropy of Oxidized Si(001) Surfaces.” <i>Physical Review B</i> 72, no. 7 (2005).
    <a href="https://doi.org/10.1103/physrevb.72.075353">https://doi.org/10.1103/physrevb.72.075353</a>.
  ieee: 'F. Fuchs, W. G. Schmidt, and F. Bechstedt, “Understanding the optical anisotropy
    of oxidized Si(001) surfaces,” <i>Physical Review B</i>, vol. 72, no. 7, 2005,
    doi: <a href="https://doi.org/10.1103/physrevb.72.075353">10.1103/physrevb.72.075353</a>.'
  mla: Fuchs, F., et al. “Understanding the Optical Anisotropy of Oxidized Si(001)
    Surfaces.” <i>Physical Review B</i>, vol. 72, no. 7, 2005, doi:<a href="https://doi.org/10.1103/physrevb.72.075353">10.1103/physrevb.72.075353</a>.
  short: F. Fuchs, W.G. Schmidt, F. Bechstedt, Physical Review B 72 (2005).
date_created: 2019-10-09T11:48:23Z
date_updated: 2025-12-05T13:18:35Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
doi: 10.1103/physrevb.72.075353
intvolume: '        72'
issue: '7'
language:
- iso: eng
publication: Physical Review B
publication_identifier:
  issn:
  - 1098-0121
  - 1550-235X
publication_status: published
status: public
title: Understanding the optical anisotropy of oxidized Si(001) surfaces
type: journal_article
user_id: '16199'
volume: 72
year: '2005'
...
---
_id: '13704'
author:
- first_name: K.
  full_name: Seino, K.
  last_name: Seino
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: Seino K, Schmidt WG. Conformation-selective adsorption of 2,3-butanediol on
    Si(001). <i>Surface Science</i>. Published online 2005:191-196. doi:<a href="https://doi.org/10.1016/j.susc.2005.04.029">10.1016/j.susc.2005.04.029</a>
  apa: Seino, K., &#38; Schmidt, W. G. (2005). Conformation-selective adsorption of
    2,3-butanediol on Si(001). <i>Surface Science</i>, 191–196. <a href="https://doi.org/10.1016/j.susc.2005.04.029">https://doi.org/10.1016/j.susc.2005.04.029</a>
  bibtex: '@article{Seino_Schmidt_2005, title={Conformation-selective adsorption of
    2,3-butanediol on Si(001)}, DOI={<a href="https://doi.org/10.1016/j.susc.2005.04.029">10.1016/j.susc.2005.04.029</a>},
    journal={Surface Science}, author={Seino, K. and Schmidt, Wolf Gero}, year={2005},
    pages={191–196} }'
  chicago: Seino, K., and Wolf Gero Schmidt. “Conformation-Selective Adsorption of
    2,3-Butanediol on Si(001).” <i>Surface Science</i>, 2005, 191–96. <a href="https://doi.org/10.1016/j.susc.2005.04.029">https://doi.org/10.1016/j.susc.2005.04.029</a>.
  ieee: 'K. Seino and W. G. Schmidt, “Conformation-selective adsorption of 2,3-butanediol
    on Si(001),” <i>Surface Science</i>, pp. 191–196, 2005, doi: <a href="https://doi.org/10.1016/j.susc.2005.04.029">10.1016/j.susc.2005.04.029</a>.'
  mla: Seino, K., and Wolf Gero Schmidt. “Conformation-Selective Adsorption of 2,3-Butanediol
    on Si(001).” <i>Surface Science</i>, 2005, pp. 191–96, doi:<a href="https://doi.org/10.1016/j.susc.2005.04.029">10.1016/j.susc.2005.04.029</a>.
  short: K. Seino, W.G. Schmidt, Surface Science (2005) 191–196.
date_created: 2019-10-09T11:51:20Z
date_updated: 2025-12-05T13:18:04Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
doi: 10.1016/j.susc.2005.04.029
language:
- iso: eng
page: 191-196
publication: Surface Science
publication_identifier:
  issn:
  - 0039-6028
publication_status: published
status: public
title: Conformation-selective adsorption of 2,3-butanediol on Si(001)
type: journal_article
user_id: '16199'
year: '2005'
...
---
_id: '13707'
author:
- first_name: Andreas
  full_name: Hermann, Andreas
  last_name: Hermann
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: Friedhelm
  full_name: Bechstedt, Friedhelm
  last_name: Bechstedt
citation:
  ama: Hermann A, Schmidt WG, Bechstedt F. Phenanthrenequinone Adsorbed on Si(001): 
    Geometries, Electronic Properties, and Optical Response. <i>The Journal of Physical
    Chemistry B</i>. 2005;109:7928-7933. doi:<a href="https://doi.org/10.1021/jp0500182">10.1021/jp0500182</a>
  apa: Hermann, A., Schmidt, W. G., &#38; Bechstedt, F. (2005). Phenanthrenequinone
    Adsorbed on Si(001):  Geometries, Electronic Properties, and Optical Response.
    <i>The Journal of Physical Chemistry B</i>, <i>109</i>, 7928–7933. <a href="https://doi.org/10.1021/jp0500182">https://doi.org/10.1021/jp0500182</a>
  bibtex: '@article{Hermann_Schmidt_Bechstedt_2005, title={Phenanthrenequinone Adsorbed
    on Si(001):  Geometries, Electronic Properties, and Optical Response}, volume={109},
    DOI={<a href="https://doi.org/10.1021/jp0500182">10.1021/jp0500182</a>}, journal={The
    Journal of Physical Chemistry B}, author={Hermann, Andreas and Schmidt, Wolf Gero
    and Bechstedt, Friedhelm}, year={2005}, pages={7928–7933} }'
  chicago: 'Hermann, Andreas, Wolf Gero Schmidt, and Friedhelm Bechstedt. “Phenanthrenequinone
    Adsorbed on Si(001):  Geometries, Electronic Properties, and Optical Response.”
    <i>The Journal of Physical Chemistry B</i> 109 (2005): 7928–33. <a href="https://doi.org/10.1021/jp0500182">https://doi.org/10.1021/jp0500182</a>.'
  ieee: 'A. Hermann, W. G. Schmidt, and F. Bechstedt, “Phenanthrenequinone Adsorbed
    on Si(001):  Geometries, Electronic Properties, and Optical Response,” <i>The
    Journal of Physical Chemistry B</i>, vol. 109, pp. 7928–7933, 2005, doi: <a href="https://doi.org/10.1021/jp0500182">10.1021/jp0500182</a>.'
  mla: Hermann, Andreas, et al. “Phenanthrenequinone Adsorbed on Si(001):  Geometries,
    Electronic Properties, and Optical Response.” <i>The Journal of Physical Chemistry
    B</i>, vol. 109, 2005, pp. 7928–33, doi:<a href="https://doi.org/10.1021/jp0500182">10.1021/jp0500182</a>.
  short: A. Hermann, W.G. Schmidt, F. Bechstedt, The Journal of Physical Chemistry
    B 109 (2005) 7928–7933.
date_created: 2019-10-09T11:58:26Z
date_updated: 2025-12-05T13:21:15Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
doi: 10.1021/jp0500182
funded_apc: '1'
intvolume: '       109'
language:
- iso: eng
page: 7928-7933
publication: The Journal of Physical Chemistry B
publication_identifier:
  issn:
  - 1520-6106
  - 1520-5207
publication_status: published
status: public
title: Phenanthrenequinone Adsorbed on Si(001):  Geometries, Electronic Properties,
  and Optical Response
type: journal_article
user_id: '16199'
volume: 109
year: '2005'
...
---
_id: '13698'
author:
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: Schmidt WG. Calculation of reflectance anisotropy for semiconductor surface
    exploration. <i>physica status solidi (b)</i>. 2005;242(13):2751-2764. doi:<a
    href="https://doi.org/10.1002/pssb.200541112">10.1002/pssb.200541112</a>
  apa: Schmidt, W. G. (2005). Calculation of reflectance anisotropy for semiconductor
    surface exploration. <i>Physica Status Solidi (b)</i>, <i>242</i>(13), 2751–2764.
    <a href="https://doi.org/10.1002/pssb.200541112">https://doi.org/10.1002/pssb.200541112</a>
  bibtex: '@article{Schmidt_2005, title={Calculation of reflectance anisotropy for
    semiconductor surface exploration}, volume={242}, DOI={<a href="https://doi.org/10.1002/pssb.200541112">10.1002/pssb.200541112</a>},
    number={13}, journal={physica status solidi (b)}, author={Schmidt, Wolf Gero},
    year={2005}, pages={2751–2764} }'
  chicago: 'Schmidt, Wolf Gero. “Calculation of Reflectance Anisotropy for Semiconductor
    Surface Exploration.” <i>Physica Status Solidi (b)</i> 242, no. 13 (2005): 2751–64.
    <a href="https://doi.org/10.1002/pssb.200541112">https://doi.org/10.1002/pssb.200541112</a>.'
  ieee: 'W. G. Schmidt, “Calculation of reflectance anisotropy for semiconductor surface
    exploration,” <i>physica status solidi (b)</i>, vol. 242, no. 13, pp. 2751–2764,
    2005, doi: <a href="https://doi.org/10.1002/pssb.200541112">10.1002/pssb.200541112</a>.'
  mla: Schmidt, Wolf Gero. “Calculation of Reflectance Anisotropy for Semiconductor
    Surface Exploration.” <i>Physica Status Solidi (b)</i>, vol. 242, no. 13, 2005,
    pp. 2751–64, doi:<a href="https://doi.org/10.1002/pssb.200541112">10.1002/pssb.200541112</a>.
  short: W.G. Schmidt, Physica Status Solidi (b) 242 (2005) 2751–2764.
date_created: 2019-10-09T11:29:20Z
date_updated: 2025-12-05T13:26:19Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
doi: 10.1002/pssb.200541112
intvolume: '       242'
issue: '13'
language:
- iso: eng
page: 2751-2764
publication: physica status solidi (b)
publication_identifier:
  issn:
  - 0370-1972
  - 1521-3951
publication_status: published
status: public
title: Calculation of reflectance anisotropy for semiconductor surface exploration
type: journal_article
user_id: '16199'
volume: 242
year: '2005'
...
---
_id: '13703'
author:
- first_name: M.
  full_name: Preuss, M.
  last_name: Preuss
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: F.
  full_name: Bechstedt, F.
  last_name: Bechstedt
citation:
  ama: 'Preuss M, Schmidt WG, Bechstedt F. Coulombic Amino Group-Metal Bonding: Adsorption
    of Adenine on Cu(110). <i>Physical Review Letters</i>. 2005;94. doi:<a href="https://doi.org/10.1103/physrevlett.94.236102">10.1103/physrevlett.94.236102</a>'
  apa: 'Preuss, M., Schmidt, W. G., &#38; Bechstedt, F. (2005). Coulombic Amino Group-Metal
    Bonding: Adsorption of Adenine on Cu(110). <i>Physical Review Letters</i>, <i>94</i>.
    <a href="https://doi.org/10.1103/physrevlett.94.236102">https://doi.org/10.1103/physrevlett.94.236102</a>'
  bibtex: '@article{Preuss_Schmidt_Bechstedt_2005, title={Coulombic Amino Group-Metal
    Bonding: Adsorption of Adenine on Cu(110)}, volume={94}, DOI={<a href="https://doi.org/10.1103/physrevlett.94.236102">10.1103/physrevlett.94.236102</a>},
    journal={Physical Review Letters}, author={Preuss, M. and Schmidt, Wolf Gero and
    Bechstedt, F.}, year={2005} }'
  chicago: 'Preuss, M., Wolf Gero Schmidt, and F. Bechstedt. “Coulombic Amino Group-Metal
    Bonding: Adsorption of Adenine on Cu(110).” <i>Physical Review Letters</i> 94
    (2005). <a href="https://doi.org/10.1103/physrevlett.94.236102">https://doi.org/10.1103/physrevlett.94.236102</a>.'
  ieee: 'M. Preuss, W. G. Schmidt, and F. Bechstedt, “Coulombic Amino Group-Metal
    Bonding: Adsorption of Adenine on Cu(110),” <i>Physical Review Letters</i>, vol.
    94, 2005, doi: <a href="https://doi.org/10.1103/physrevlett.94.236102">10.1103/physrevlett.94.236102</a>.'
  mla: 'Preuss, M., et al. “Coulombic Amino Group-Metal Bonding: Adsorption of Adenine
    on Cu(110).” <i>Physical Review Letters</i>, vol. 94, 2005, doi:<a href="https://doi.org/10.1103/physrevlett.94.236102">10.1103/physrevlett.94.236102</a>.'
  short: M. Preuss, W.G. Schmidt, F. Bechstedt, Physical Review Letters 94 (2005).
date_created: 2019-10-09T11:50:16Z
date_updated: 2025-12-05T13:26:36Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
doi: 10.1103/physrevlett.94.236102
intvolume: '        94'
language:
- iso: eng
publication: Physical Review Letters
publication_identifier:
  issn:
  - 0031-9007
  - 1079-7114
publication_status: published
status: public
title: 'Coulombic Amino Group-Metal Bonding: Adsorption of Adenine on Cu(110)'
type: journal_article
user_id: '16199'
volume: 94
year: '2005'
...
---
_id: '13846'
author:
- first_name: P. H.
  full_name: Hahn, P. H.
  last_name: Hahn
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: F.
  full_name: Bechstedt, F.
  last_name: Bechstedt
citation:
  ama: 'Hahn PH, Schmidt WG, Bechstedt F. Molecular electronic excitations calculated
    from a solid-state approach: Methodology and numerics. <i>Physical Review B</i>.
    2005;72(24). doi:<a href="https://doi.org/10.1103/physrevb.72.245425">10.1103/physrevb.72.245425</a>'
  apa: 'Hahn, P. H., Schmidt, W. G., &#38; Bechstedt, F. (2005). Molecular electronic
    excitations calculated from a solid-state approach: Methodology and numerics.
    <i>Physical Review B</i>, <i>72</i>(24). <a href="https://doi.org/10.1103/physrevb.72.245425">https://doi.org/10.1103/physrevb.72.245425</a>'
  bibtex: '@article{Hahn_Schmidt_Bechstedt_2005, title={Molecular electronic excitations
    calculated from a solid-state approach: Methodology and numerics}, volume={72},
    DOI={<a href="https://doi.org/10.1103/physrevb.72.245425">10.1103/physrevb.72.245425</a>},
    number={24}, journal={Physical Review B}, author={Hahn, P. H. and Schmidt, Wolf
    Gero and Bechstedt, F.}, year={2005} }'
  chicago: 'Hahn, P. H., Wolf Gero Schmidt, and F. Bechstedt. “Molecular Electronic
    Excitations Calculated from a Solid-State Approach: Methodology and Numerics.”
    <i>Physical Review B</i> 72, no. 24 (2005). <a href="https://doi.org/10.1103/physrevb.72.245425">https://doi.org/10.1103/physrevb.72.245425</a>.'
  ieee: 'P. H. Hahn, W. G. Schmidt, and F. Bechstedt, “Molecular electronic excitations
    calculated from a solid-state approach: Methodology and numerics,” <i>Physical
    Review B</i>, vol. 72, no. 24, 2005, doi: <a href="https://doi.org/10.1103/physrevb.72.245425">10.1103/physrevb.72.245425</a>.'
  mla: 'Hahn, P. H., et al. “Molecular Electronic Excitations Calculated from a Solid-State
    Approach: Methodology and Numerics.” <i>Physical Review B</i>, vol. 72, no. 24,
    2005, doi:<a href="https://doi.org/10.1103/physrevb.72.245425">10.1103/physrevb.72.245425</a>.'
  short: P.H. Hahn, W.G. Schmidt, F. Bechstedt, Physical Review B 72 (2005).
date_created: 2019-10-15T08:24:29Z
date_updated: 2025-12-16T07:40:50Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
doi: 10.1103/physrevb.72.245425
intvolume: '        72'
issue: '24'
language:
- iso: eng
publication: Physical Review B
publication_identifier:
  issn:
  - 1098-0121
  - 1550-235X
publication_status: published
status: public
title: 'Molecular electronic excitations calculated from a solid-state approach: Methodology
  and numerics'
type: journal_article
user_id: '16199'
volume: 72
year: '2005'
...
---
_id: '15849'
author:
- first_name: Stefan
  full_name: Schumacher, Stefan
  id: '27271'
  last_name: Schumacher
  orcid: 0000-0003-4042-4951
- first_name: G.
  full_name: Czycholl, G.
  last_name: Czycholl
- first_name: F.
  full_name: Jahnke, F.
  last_name: Jahnke
- first_name: I.
  full_name: Kudyk, I.
  last_name: Kudyk
- first_name: H. I.
  full_name: Rückmann, H. I.
  last_name: Rückmann
- first_name: J.
  full_name: Gutowski, J.
  last_name: Gutowski
- first_name: A.
  full_name: Gust, A.
  last_name: Gust
- first_name: G.
  full_name: Alexe, G.
  last_name: Alexe
- first_name: D.
  full_name: Hommel, D.
  last_name: Hommel
citation:
  ama: 'Schumacher S, Czycholl G, Jahnke F, et al. Polariton propagation in shallow-confinement
    heterostructures: Microscopic theory and experiment showing the breakdown of the
    dead-layer concept. <i>Physical Review B</i>. Published online 2005. doi:<a href="https://doi.org/10.1103/physrevb.70.235340">10.1103/physrevb.70.235340</a>'
  apa: 'Schumacher, S., Czycholl, G., Jahnke, F., Kudyk, I., Rückmann, H. I., Gutowski,
    J., Gust, A., Alexe, G., &#38; Hommel, D. (2005). Polariton propagation in shallow-confinement
    heterostructures: Microscopic theory and experiment showing the breakdown of the
    dead-layer concept. <i>Physical Review B</i>. <a href="https://doi.org/10.1103/physrevb.70.235340">https://doi.org/10.1103/physrevb.70.235340</a>'
  bibtex: '@article{Schumacher_Czycholl_Jahnke_Kudyk_Rückmann_Gutowski_Gust_Alexe_Hommel_2005,
    title={Polariton propagation in shallow-confinement heterostructures: Microscopic
    theory and experiment showing the breakdown of the dead-layer concept}, DOI={<a
    href="https://doi.org/10.1103/physrevb.70.235340">10.1103/physrevb.70.235340</a>},
    journal={Physical Review B}, author={Schumacher, Stefan and Czycholl, G. and Jahnke,
    F. and Kudyk, I. and Rückmann, H. I. and Gutowski, J. and Gust, A. and Alexe,
    G. and Hommel, D.}, year={2005} }'
  chicago: 'Schumacher, Stefan, G. Czycholl, F. Jahnke, I. Kudyk, H. I. Rückmann,
    J. Gutowski, A. Gust, G. Alexe, and D. Hommel. “Polariton Propagation in Shallow-Confinement
    Heterostructures: Microscopic Theory and Experiment Showing the Breakdown of the
    Dead-Layer Concept.” <i>Physical Review B</i>, 2005. <a href="https://doi.org/10.1103/physrevb.70.235340">https://doi.org/10.1103/physrevb.70.235340</a>.'
  ieee: 'S. Schumacher <i>et al.</i>, “Polariton propagation in shallow-confinement
    heterostructures: Microscopic theory and experiment showing the breakdown of the
    dead-layer concept,” <i>Physical Review B</i>, 2005, doi: <a href="https://doi.org/10.1103/physrevb.70.235340">10.1103/physrevb.70.235340</a>.'
  mla: 'Schumacher, Stefan, et al. “Polariton Propagation in Shallow-Confinement Heterostructures:
    Microscopic Theory and Experiment Showing the Breakdown of the Dead-Layer Concept.”
    <i>Physical Review B</i>, 2005, doi:<a href="https://doi.org/10.1103/physrevb.70.235340">10.1103/physrevb.70.235340</a>.'
  short: S. Schumacher, G. Czycholl, F. Jahnke, I. Kudyk, H.I. Rückmann, J. Gutowski,
    A. Gust, G. Alexe, D. Hommel, Physical Review B (2005).
date_created: 2020-02-10T11:23:08Z
date_updated: 2025-12-16T08:01:59Z
department:
- _id: '15'
- _id: '170'
- _id: '297'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1103/physrevb.70.235340
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Physical Review B
publication_identifier:
  issn:
  - 1098-0121
  - 1550-235X
publication_status: published
status: public
title: 'Polariton propagation in shallow-confinement heterostructures: Microscopic
  theory and experiment showing the breakdown of the dead-layer concept'
type: journal_article
user_id: '16199'
year: '2005'
...
---
_id: '15850'
author:
- first_name: Stefan
  full_name: Schumacher, Stefan
  id: '27271'
  last_name: Schumacher
  orcid: 0000-0003-4042-4951
- first_name: G.
  full_name: Czycholl, G.
  last_name: Czycholl
- first_name: F.
  full_name: Jahnke, F.
  last_name: Jahnke
- first_name: I.
  full_name: Kudyk, I.
  last_name: Kudyk
- first_name: L.
  full_name: Wischmeier, L.
  last_name: Wischmeier
- first_name: I.
  full_name: Rückmann, I.
  last_name: Rückmann
- first_name: T.
  full_name: Voss, T.
  last_name: Voss
- first_name: J.
  full_name: Gutowski, J.
  last_name: Gutowski
- first_name: A.
  full_name: Gust, A.
  last_name: Gust
- first_name: D.
  full_name: Hommel, D.
  last_name: Hommel
citation:
  ama: 'Schumacher S, Czycholl G, Jahnke F, et al. Coherent propagation of polaritons
    in semiconductor heterostructures: Nonlinear pulse transmission in theory and
    experiment. <i>Physical Review B</i>. Published online 2005. doi:<a href="https://doi.org/10.1103/physrevb.72.081308">10.1103/physrevb.72.081308</a>'
  apa: 'Schumacher, S., Czycholl, G., Jahnke, F., Kudyk, I., Wischmeier, L., Rückmann,
    I., Voss, T., Gutowski, J., Gust, A., &#38; Hommel, D. (2005). Coherent propagation
    of polaritons in semiconductor heterostructures: Nonlinear pulse transmission
    in theory and experiment. <i>Physical Review B</i>. <a href="https://doi.org/10.1103/physrevb.72.081308">https://doi.org/10.1103/physrevb.72.081308</a>'
  bibtex: '@article{Schumacher_Czycholl_Jahnke_Kudyk_Wischmeier_Rückmann_Voss_Gutowski_Gust_Hommel_2005,
    title={Coherent propagation of polaritons in semiconductor heterostructures: Nonlinear
    pulse transmission in theory and experiment}, DOI={<a href="https://doi.org/10.1103/physrevb.72.081308">10.1103/physrevb.72.081308</a>},
    journal={Physical Review B}, author={Schumacher, Stefan and Czycholl, G. and Jahnke,
    F. and Kudyk, I. and Wischmeier, L. and Rückmann, I. and Voss, T. and Gutowski,
    J. and Gust, A. and Hommel, D.}, year={2005} }'
  chicago: 'Schumacher, Stefan, G. Czycholl, F. Jahnke, I. Kudyk, L. Wischmeier, I.
    Rückmann, T. Voss, J. Gutowski, A. Gust, and D. Hommel. “Coherent Propagation
    of Polaritons in Semiconductor Heterostructures: Nonlinear Pulse Transmission
    in Theory and Experiment.” <i>Physical Review B</i>, 2005. <a href="https://doi.org/10.1103/physrevb.72.081308">https://doi.org/10.1103/physrevb.72.081308</a>.'
  ieee: 'S. Schumacher <i>et al.</i>, “Coherent propagation of polaritons in semiconductor
    heterostructures: Nonlinear pulse transmission in theory and experiment,” <i>Physical
    Review B</i>, 2005, doi: <a href="https://doi.org/10.1103/physrevb.72.081308">10.1103/physrevb.72.081308</a>.'
  mla: 'Schumacher, Stefan, et al. “Coherent Propagation of Polaritons in Semiconductor
    Heterostructures: Nonlinear Pulse Transmission in Theory and Experiment.” <i>Physical
    Review B</i>, 2005, doi:<a href="https://doi.org/10.1103/physrevb.72.081308">10.1103/physrevb.72.081308</a>.'
  short: S. Schumacher, G. Czycholl, F. Jahnke, I. Kudyk, L. Wischmeier, I. Rückmann,
    T. Voss, J. Gutowski, A. Gust, D. Hommel, Physical Review B (2005).
date_created: 2020-02-10T11:25:36Z
date_updated: 2025-12-16T08:01:29Z
department:
- _id: '15'
- _id: '170'
- _id: '297'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1103/physrevb.72.081308
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Physical Review B
publication_identifier:
  issn:
  - 1098-0121
  - 1550-235X
publication_status: published
status: public
title: 'Coherent propagation of polaritons in semiconductor heterostructures: Nonlinear
  pulse transmission in theory and experiment'
type: journal_article
user_id: '16199'
year: '2005'
...
---
_id: '23503'
author:
- first_name: R.
  full_name: Oszwałdowski, R.
  last_name: Oszwałdowski
- first_name: Matthias
  full_name: Reichelt, Matthias
  id: '138'
  last_name: Reichelt
- first_name: Torsten
  full_name: Meier, Torsten
  id: '344'
  last_name: Meier
  orcid: 0000-0001-8864-2072
- first_name: S. W.
  full_name: Koch, S. W.
  last_name: Koch
- first_name: Michael
  full_name: Rohlfing, Michael
  last_name: Rohlfing
citation:
  ama: 'Oszwałdowski R, Reichelt M, Meier T, Koch SW, Rohlfing M. Nonlinear optical
    response of the  Si ( 111 ) − ( 2 × 1 )  surface exciton: Influence of biexciton
    many-body correlations. <i>Physical Review B</i>. 2005;71(23). doi:<a href="https://doi.org/10.1103/physrevb.71.235324">10.1103/physrevb.71.235324</a>'
  apa: 'Oszwałdowski, R., Reichelt, M., Meier, T., Koch, S. W., &#38; Rohlfing, M.
    (2005). Nonlinear optical response of the  Si ( 111 ) − ( 2 × 1 )  surface exciton:
    Influence of biexciton many-body correlations. <i>Physical Review B</i>, <i>71</i>(23).
    <a href="https://doi.org/10.1103/physrevb.71.235324">https://doi.org/10.1103/physrevb.71.235324</a>'
  bibtex: '@article{Oszwałdowski_Reichelt_Meier_Koch_Rohlfing_2005, title={Nonlinear
    optical response of the  Si ( 111 ) − ( 2 × 1 )  surface exciton: Influence of
    biexciton many-body correlations}, volume={71}, DOI={<a href="https://doi.org/10.1103/physrevb.71.235324">10.1103/physrevb.71.235324</a>},
    number={23}, journal={Physical Review B}, author={Oszwałdowski, R. and Reichelt,
    Matthias and Meier, Torsten and Koch, S. W. and Rohlfing, Michael}, year={2005}
    }'
  chicago: 'Oszwałdowski, R., Matthias Reichelt, Torsten Meier, S. W. Koch, and Michael
    Rohlfing. “Nonlinear Optical Response of the  Si ( 111 ) − ( 2 × 1 )  Surface
    Exciton: Influence of Biexciton Many-Body Correlations.” <i>Physical Review B</i>
    71, no. 23 (2005). <a href="https://doi.org/10.1103/physrevb.71.235324">https://doi.org/10.1103/physrevb.71.235324</a>.'
  ieee: 'R. Oszwałdowski, M. Reichelt, T. Meier, S. W. Koch, and M. Rohlfing, “Nonlinear
    optical response of the  Si ( 111 ) − ( 2 × 1 )  surface exciton: Influence of
    biexciton many-body correlations,” <i>Physical Review B</i>, vol. 71, no. 23,
    2005, doi: <a href="https://doi.org/10.1103/physrevb.71.235324">10.1103/physrevb.71.235324</a>.'
  mla: 'Oszwałdowski, R., et al. “Nonlinear Optical Response of the  Si ( 111 ) −
    ( 2 × 1 )  Surface Exciton: Influence of Biexciton Many-Body Correlations.” <i>Physical
    Review B</i>, vol. 71, no. 23, 2005, doi:<a href="https://doi.org/10.1103/physrevb.71.235324">10.1103/physrevb.71.235324</a>.'
  short: R. Oszwałdowski, M. Reichelt, T. Meier, S.W. Koch, M. Rohlfing, Physical
    Review B 71 (2005).
date_created: 2021-08-24T09:26:55Z
date_updated: 2025-12-16T11:34:03Z
department:
- _id: '15'
- _id: '170'
- _id: '293'
- _id: '35'
- _id: '230'
doi: 10.1103/physrevb.71.235324
extern: '1'
intvolume: '        71'
issue: '23'
language:
- iso: eng
publication: Physical Review B
publication_identifier:
  issn:
  - 1098-0121
  - 1550-235X
publication_status: published
status: public
title: 'Nonlinear optical response of the  Si ( 111 ) − ( 2 × 1 )  surface exciton:
  Influence of biexciton many-body correlations'
type: journal_article
user_id: '16199'
volume: 71
year: '2005'
...
---
_id: '58598'
abstract:
- lang: eng
  text: <jats:title>Abstract</jats:title><jats:p>A series of bis‐guanidine ligands
    designed for use in biomimetic coordination chemistry has been extended to a library
    matrix combining unprecedented substitutional flexibility within the guanidyl
    residues with a wide range of aliphatic and aromatic spacers connecting these
    functionalities. The underlying protocol can be used with predefined ureas as
    well as secondary amines to build up these units by reaction with phosgene if
    the ureas are otherwise unavailable. In the latter case, the resulting urea intermediates
    do not have to be isolated as the reaction proceeds further with additional phosgene
    to yield a chloroformamidinium chloride which is transformed into the bis‐guanidine
    functionality by subsequent reaction with a suitable primary diamine in the presence
    of triethylamine as an auxiliary base. This concept has been used to synthesise
    and characterise more then two dozen different bis‐guanidines based on 12 discrete
    monoguanidine units and seven different spacers. These spacers have been chosen
    such that the most important phenotypes have been dealt with and which range from
    rigid to more flexible scaffolds. In addition to spacers with no metal‐binding
    capabilities, other species containing further donor functions such as <jats:italic>N</jats:italic>‐methyldiphenyleneamine
    or pyridine‐2,6‐diyl have also been used. The substitution patterns of the guanidine
    residues can be classified into acyclic and cyclic types. Among the cyclic types,
    one subset is characterised by five‐ or six‐membered heterocycles containing both
    the amino nitrogen atoms and another one by individual N‐heterocyclic systems
    for each amino nitrogen. Structurally characterised examples are 2‐{2‐[2‐(tetramethylguanidi­no)ethoxy]ethoxy}‐1‐(tetramethylguanidino)ethane
    (TMG<jats:sub>2</jats:sub>doo) in its diprotonated form and 2,2′‐bis[2<jats:italic>N</jats:italic>‐(1,1′,3,3′‐tetramethylguanidine)]diphenyleneamine
    (TMG<jats:sub>2</jats:sub>PA) as wellas <jats:italic>N</jats:italic><jats:sup>1</jats:sup>,<jats:italic>N</jats:italic><jats:sup>3</jats:sup>‐bis(dimorpholinomethylene)propane‐1,3‐diamine
    (DMorphG<jats:sub>2</jats:sub>p) as free bases. For the permethylated bis‐guanidine
    derivatives, the barrier to rotation around the (C=N)<jats:sub>guanidine</jats:sub>
    bond has been determined by means of temperature‐dependent EXSY <jats:sup>1</jats:sup>H
    NMR spectroscopy to range between 54 and 79 kJ mol<jats:sup>–1</jats:sup> depending
    on the type of spacer. (© Wiley‐VCH Verlag GmbH &amp; Co. KGaA, 69451 Weinheim,
    Germany, 2005)</jats:p>
author:
- first_name: Sonja
  full_name: Herres‐Pawlis, Sonja
  last_name: Herres‐Pawlis
- first_name: Adam
  full_name: Neuba, Adam
  last_name: Neuba
- first_name: Oliver
  full_name: Seewald, Oliver
  id: '495'
  last_name: Seewald
- first_name: Tarimala
  full_name: Seshadri, Tarimala
  last_name: Seshadri
- first_name: Hans
  full_name: Egold, Hans
  last_name: Egold
- first_name: Ulrich
  full_name: Flörke, Ulrich
  last_name: Flörke
- first_name: Gerald
  full_name: Henkel, Gerald
  last_name: Henkel
citation:
  ama: Herres‐Pawlis S, Neuba A, Seewald O, et al. A Library of Peralkylated Bis‐guanidine
    Ligands for Use in Biomimetic Coordination Chemistry. <i>European Journal of Organic
    Chemistry</i>. 2005;2005(22):4879-4890. doi:<a href="https://doi.org/10.1002/ejoc.200500340">10.1002/ejoc.200500340</a>
  apa: Herres‐Pawlis, S., Neuba, A., Seewald, O., Seshadri, T., Egold, H., Flörke,
    U., &#38; Henkel, G. (2005). A Library of Peralkylated Bis‐guanidine Ligands for
    Use in Biomimetic Coordination Chemistry. <i>European Journal of Organic Chemistry</i>,
    <i>2005</i>(22), 4879–4890. <a href="https://doi.org/10.1002/ejoc.200500340">https://doi.org/10.1002/ejoc.200500340</a>
  bibtex: '@article{Herres‐Pawlis_Neuba_Seewald_Seshadri_Egold_Flörke_Henkel_2005,
    title={A Library of Peralkylated Bis‐guanidine Ligands for Use in Biomimetic Coordination
    Chemistry}, volume={2005}, DOI={<a href="https://doi.org/10.1002/ejoc.200500340">10.1002/ejoc.200500340</a>},
    number={22}, journal={European Journal of Organic Chemistry}, publisher={Wiley},
    author={Herres‐Pawlis, Sonja and Neuba, Adam and Seewald, Oliver and Seshadri,
    Tarimala and Egold, Hans and Flörke, Ulrich and Henkel, Gerald}, year={2005},
    pages={4879–4890} }'
  chicago: 'Herres‐Pawlis, Sonja, Adam Neuba, Oliver Seewald, Tarimala Seshadri, Hans
    Egold, Ulrich Flörke, and Gerald Henkel. “A Library of Peralkylated Bis‐guanidine
    Ligands for Use in Biomimetic Coordination Chemistry.” <i>European Journal of
    Organic Chemistry</i> 2005, no. 22 (2005): 4879–90. <a href="https://doi.org/10.1002/ejoc.200500340">https://doi.org/10.1002/ejoc.200500340</a>.'
  ieee: 'S. Herres‐Pawlis <i>et al.</i>, “A Library of Peralkylated Bis‐guanidine
    Ligands for Use in Biomimetic Coordination Chemistry,” <i>European Journal of
    Organic Chemistry</i>, vol. 2005, no. 22, pp. 4879–4890, 2005, doi: <a href="https://doi.org/10.1002/ejoc.200500340">10.1002/ejoc.200500340</a>.'
  mla: Herres‐Pawlis, Sonja, et al. “A Library of Peralkylated Bis‐guanidine Ligands
    for Use in Biomimetic Coordination Chemistry.” <i>European Journal of Organic
    Chemistry</i>, vol. 2005, no. 22, Wiley, 2005, pp. 4879–90, doi:<a href="https://doi.org/10.1002/ejoc.200500340">10.1002/ejoc.200500340</a>.
  short: S. Herres‐Pawlis, A. Neuba, O. Seewald, T. Seshadri, H. Egold, U. Flörke,
    G. Henkel, European Journal of Organic Chemistry 2005 (2005) 4879–4890.
date_created: 2025-02-12T09:27:00Z
date_updated: 2025-02-12T09:30:43Z
department:
- _id: '321'
- _id: '35'
- _id: '301'
doi: 10.1002/ejoc.200500340
intvolume: '      2005'
issue: '22'
language:
- iso: eng
page: 4879-4890
publication: European Journal of Organic Chemistry
publication_identifier:
  issn:
  - 1434-193X
  - 1099-0690
publication_status: published
publisher: Wiley
status: public
title: A Library of Peralkylated Bis‐guanidine Ligands for Use in Biomimetic Coordination
  Chemistry
type: journal_article
user_id: '495'
volume: 2005
year: '2005'
...
---
_id: '58597'
abstract:
- lang: eng
  text: <jats:title>Abstract</jats:title><jats:p><jats:bold>Syntheses and Structure
    of Chiral Metallatetrahedron Complexes of the Type [Re<jats:sub>2</jats:sub>(M<jats:sup>1</jats:sup>PPh<jats:sub>3</jats:sub>)(M<jats:sup>2</jats:sup>PPh<jats:sub>3</jats:sub>)(μ‐PCy<jats:sub>2</jats:sub>)(CO)<jats:sub>7</jats:sub>C≡CPh]
    (M<jats:sup>1</jats:sup> = Ag, Au; M<jats:sup>2</jats:sup> = Cu, Ag, Au)</jats:bold></jats:p><jats:p>From
    the reaction of Li[Re<jats:sub>2</jats:sub>(μ‐H)(μ‐PCy<jats:sub>2</jats:sub>)(CO)<jats:sub>7</jats:sub>(C(Ph)O)]
    (<jats:bold>1</jats:bold>) with Ph<jats:sub>3</jats:sub>AuC≡CPh both benzaldehyde
    and the trinuclear complex Li[Re<jats:sub>2</jats:sub>(AuPPh<jats:sub>3</jats:sub>)(μ‐PCy<jats:sub>2</jats:sub>)(CO)<jats:sub>7</jats:sub>C≡CPh]
    (<jats:bold>2a</jats:bold>) were obtained in high yield. The complex anion was
    isolated as its PPh<jats:sub>4</jats:sub>‐salt <jats:bold>2b</jats:bold>. The
    latter reacts with coinage metal complexes PPh<jats:sub>3</jats:sub>M<jats:sup>2</jats:sup>Cl
    [M<jats:sup>2</jats:sup> = Cu, Ag, Au] to give chiral heterometallatetrahedranes
    of the general formula [Re<jats:sub>2</jats:sub>(AuPPh<jats:sub>3</jats:sub>)(M<jats:sup>2</jats:sup>PPh<jats:sub>3</jats:sub>)(μ‐PCy<jats:sub>2</jats:sub>)(CO)<jats:sub>7</jats:sub>C≡CPh]
    (M<jats:sup>2</jats:sup> = Cu <jats:bold>3a</jats:bold>, Ag <jats:bold>3b</jats:bold>,
    Au <jats:bold>3c</jats:bold>). The corresponding complex [Re<jats:sub>2</jats:sub>(AgPPh<jats:sub>3</jats:sub>)<jats:sub>2</jats:sub>(μ‐PCy<jats:sub>2</jats:sub>)(CO)<jats:sub>7</jats:sub>C≡CPh]
    (<jats:bold>3d</jats:bold>) is obtained from the reaction of [Re<jats:sub>2</jats:sub>(AgPPh<jats:sub>3</jats:sub>)<jats:sub>2</jats:sub>(μ‐PCy<jats:sub>2</jats:sub>)(CO)<jats:sub>7</jats:sub>Cl]
    (<jats:bold>4</jats:bold>) with LiC≡CPh. <jats:bold>3d</jats:bold> undergoes a
    metathesis reaction in the presence of PPh<jats:sub>3</jats:sub>CuCl giving [Re<jats:sub>2</jats:sub>(AgPPh<jats:sub>3</jats:sub>)(CuPPh<jats:sub>3</jats:sub>)(μ‐PCy<jats:sub>2</jats:sub>)(CO)<jats:sub>7</jats:sub>C≡CPh]
    (<jats:bold>3e</jats:bold>) and PPh<jats:sub>3</jats:sub>AgCl. Analogous metathesis
    reactions are observed when <jats:bold>3c</jats:bold> is reacted with PPh<jats:sub>3</jats:sub>AgCl
    or PPh<jats:sub>3</jats:sub>CuCl giving <jats:bold>3a</jats:bold> or <jats:bold>3b</jats:bold>,
    respectively. The reaction of <jats:bold>1</jats:bold> with PPh<jats:sub>3</jats:sub>AuCl
    gives benzaldehyde and Li[Re<jats:sub>2</jats:sub>(AuPPh<jats:sub>3</jats:sub>)(μ‐PCy<jats:sub>2</jats:sub>)(CO)<jats:sub>7</jats:sub>Cl]
    (<jats:bold>5a</jats:bold>) which upon reaction with PhLi forms the trinuclear
    complex Li[Re<jats:sub>2</jats:sub>(AuPPh<jats:sub>3</jats:sub>)(μ‐PCy<jats:sub>2</jats:sub>)(CO)<jats:sub>7</jats:sub>Ph]
    (<jats:bold>6a</jats:bold>). Again this complex was isolated as its PPh<jats:sub>4</jats:sub>‐salt
    <jats:bold>6b</jats:bold>. In contrast to <jats:bold>2b</jats:bold>, <jats:bold>6b</jats:bold>
    reacts with one equivalent of Ph<jats:sub>3</jats:sub>PAuCl by transmetalation
    to give Ph<jats:sub>3</jats:sub>PAuPh and PPh<jats:sub>4</jats:sub>[Re<jats:sub>2</jats:sub>(AuPPh<jats:sub>3</jats:sub>)(μ‐PCy<jats:sub>2</jats:sub>)(CO)<jats:sub>7</jats:sub>Cl]
    (<jats:bold>5b</jats:bold>). The X‐ray structures of the compounds <jats:bold>3a</jats:bold>,
    <jats:bold>3b</jats:bold>, <jats:bold>3e</jats:bold> and <jats:bold>4</jats:bold>
    are reported.</jats:p>
author:
- first_name: Oliver
  full_name: Seewald, Oliver
  id: '495'
  last_name: Seewald
- first_name: Ulrich
  full_name: Flörke, Ulrich
  last_name: Flörke
- first_name: Hans
  full_name: Egold, Hans
  last_name: Egold
- first_name: Hans‐Jürgen
  full_name: Haupt, Hans‐Jürgen
  last_name: Haupt
- first_name: Meinhard
  full_name: Schwefer, Meinhard
  last_name: Schwefer
citation:
  ama: Seewald O, Flörke U, Egold H, Haupt H, Schwefer M. Synthese und Struktur chiraler
    Heterometallatetrahedrane des Typs [Re<sub>2</sub>(M<sup>1</sup>PPh<sub>3</sub>)(M<sup>2</sup>PPh<sub>3</sub>)(μ‐PCy<sub>2</sub>)(CO)<sub>7</sub>C≡CPh]
    (M<sup>1</sup> = Ag, Au; M<sup>2</sup> = Cu, Ag, Au). <i>Zeitschrift für anorganische
    und allgemeine Chemie</i>. 2005;632(2):204-210. doi:<a href="https://doi.org/10.1002/zaac.200500340">10.1002/zaac.200500340</a>
  apa: Seewald, O., Flörke, U., Egold, H., Haupt, H., &#38; Schwefer, M. (2005). Synthese
    und Struktur chiraler Heterometallatetrahedrane des Typs [Re<sub>2</sub>(M<sup>1</sup>PPh<sub>3</sub>)(M<sup>2</sup>PPh<sub>3</sub>)(μ‐PCy<sub>2</sub>)(CO)<sub>7</sub>C≡CPh]
    (M<sup>1</sup> = Ag, Au; M<sup>2</sup> = Cu, Ag, Au). <i>Zeitschrift Für Anorganische
    Und Allgemeine Chemie</i>, <i>632</i>(2), 204–210. <a href="https://doi.org/10.1002/zaac.200500340">https://doi.org/10.1002/zaac.200500340</a>
  bibtex: '@article{Seewald_Flörke_Egold_Haupt_Schwefer_2005, title={Synthese und
    Struktur chiraler Heterometallatetrahedrane des Typs [Re<sub>2</sub>(M<sup>1</sup>PPh<sub>3</sub>)(M<sup>2</sup>PPh<sub>3</sub>)(μ‐PCy<sub>2</sub>)(CO)<sub>7</sub>C≡CPh]
    (M<sup>1</sup> = Ag, Au; M<sup>2</sup> = Cu, Ag, Au)}, volume={632}, DOI={<a href="https://doi.org/10.1002/zaac.200500340">10.1002/zaac.200500340</a>},
    number={2}, journal={Zeitschrift für anorganische und allgemeine Chemie}, publisher={Wiley},
    author={Seewald, Oliver and Flörke, Ulrich and Egold, Hans and Haupt, Hans‐Jürgen
    and Schwefer, Meinhard}, year={2005}, pages={204–210} }'
  chicago: 'Seewald, Oliver, Ulrich Flörke, Hans Egold, Hans‐Jürgen Haupt, and Meinhard
    Schwefer. “Synthese Und Struktur Chiraler Heterometallatetrahedrane Des Typs [Re<sub>2</sub>(M<sup>1</sup>PPh<sub>3</sub>)(M<sup>2</sup>PPh<sub>3</sub>)(Μ‐PCy<sub>2</sub>)(CO)<sub>7</sub>C≡CPh]
    (M<sup>1</sup> = Ag, Au; M<sup>2</sup> = Cu, Ag, Au).” <i>Zeitschrift Für Anorganische
    Und Allgemeine Chemie</i> 632, no. 2 (2005): 204–10. <a href="https://doi.org/10.1002/zaac.200500340">https://doi.org/10.1002/zaac.200500340</a>.'
  ieee: 'O. Seewald, U. Flörke, H. Egold, H. Haupt, and M. Schwefer, “Synthese und
    Struktur chiraler Heterometallatetrahedrane des Typs [Re<sub>2</sub>(M<sup>1</sup>PPh<sub>3</sub>)(M<sup>2</sup>PPh<sub>3</sub>)(μ‐PCy<sub>2</sub>)(CO)<sub>7</sub>C≡CPh]
    (M<sup>1</sup> = Ag, Au; M<sup>2</sup> = Cu, Ag, Au),” <i>Zeitschrift für anorganische
    und allgemeine Chemie</i>, vol. 632, no. 2, pp. 204–210, 2005, doi: <a href="https://doi.org/10.1002/zaac.200500340">10.1002/zaac.200500340</a>.'
  mla: Seewald, Oliver, et al. “Synthese Und Struktur Chiraler Heterometallatetrahedrane
    Des Typs [Re<sub>2</sub>(M<sup>1</sup>PPh<sub>3</sub>)(M<sup>2</sup>PPh<sub>3</sub>)(Μ‐PCy<sub>2</sub>)(CO)<sub>7</sub>C≡CPh]
    (M<sup>1</sup> = Ag, Au; M<sup>2</sup> = Cu, Ag, Au).” <i>Zeitschrift Für Anorganische
    Und Allgemeine Chemie</i>, vol. 632, no. 2, Wiley, 2005, pp. 204–10, doi:<a href="https://doi.org/10.1002/zaac.200500340">10.1002/zaac.200500340</a>.
  short: O. Seewald, U. Flörke, H. Egold, H. Haupt, M. Schwefer, Zeitschrift Für Anorganische
    Und Allgemeine Chemie 632 (2005) 204–210.
date_created: 2025-02-12T09:26:12Z
date_updated: 2025-02-12T09:30:52Z
department:
- _id: '321'
- _id: '35'
- _id: '301'
doi: 10.1002/zaac.200500340
intvolume: '       632'
issue: '2'
language:
- iso: eng
page: 204-210
publication: Zeitschrift für anorganische und allgemeine Chemie
publication_identifier:
  issn:
  - 0044-2313
  - 1521-3749
publication_status: published
publisher: Wiley
status: public
title: Synthese und Struktur chiraler Heterometallatetrahedrane des Typs [Re<sub>2</sub>(M<sup>1</sup>PPh<sub>3</sub>)(M<sup>2</sup>PPh<sub>3</sub>)(μ‐PCy<sub>2</sub>)(CO)<sub>7</sub>C≡CPh]
  (M<sup>1</sup> = Ag, Au; M<sup>2</sup> = Cu, Ag, Au)
type: journal_article
user_id: '495'
volume: 632
year: '2005'
...
---
_id: '50620'
author:
- first_name: Stefanie
  full_name: Aschhoff, Stefanie
  id: '26628'
  last_name: Aschhoff
- first_name: Ulrich
  full_name: Voigt, Ulrich
  last_name: Voigt
citation:
  ama: Aschhoff S, Voigt U. Freizeitverhalten und Drogenkonsum von Schülern der Schule
    für Erziehungshilfe und Lernbehinderte. <i>Zeitschrift für Jugendkriminalrecht
    und Jugendhilfe</i>. 2005;16:273–279.
  apa: Aschhoff, S., &#38; Voigt, U. (2005). Freizeitverhalten und Drogenkonsum von
    Schülern der Schule für Erziehungshilfe und Lernbehinderte. <i>Zeitschrift für
    Jugendkriminalrecht und Jugendhilfe</i>, <i>16</i>, 273–279.
  bibtex: '@article{Aschhoff_Voigt_2005, title={Freizeitverhalten und Drogenkonsum
    von Schülern der Schule für Erziehungshilfe und Lernbehinderte}, volume={16},
    journal={Zeitschrift für Jugendkriminalrecht und Jugendhilfe}, author={Aschhoff,
    Stefanie and Voigt, Ulrich}, year={2005}, pages={273–279} }'
  chicago: 'Aschhoff, Stefanie, and Ulrich Voigt. “Freizeitverhalten und Drogenkonsum
    von Schülern der Schule für Erziehungshilfe und Lernbehinderte.” <i>Zeitschrift
    für Jugendkriminalrecht und Jugendhilfe</i> 16 (2005): 273–279.'
  ieee: S. Aschhoff and U. Voigt, “Freizeitverhalten und Drogenkonsum von Schülern
    der Schule für Erziehungshilfe und Lernbehinderte,” <i>Zeitschrift für Jugendkriminalrecht
    und Jugendhilfe</i>, vol. 16, pp. 273–279, 2005.
  mla: Aschhoff, Stefanie, and Ulrich Voigt. “Freizeitverhalten und Drogenkonsum von
    Schülern der Schule für Erziehungshilfe und Lernbehinderte.” <i>Zeitschrift für
    Jugendkriminalrecht und Jugendhilfe</i>, vol. 16, 2005, pp. 273–279.
  short: S. Aschhoff, U. Voigt, Zeitschrift für Jugendkriminalrecht und Jugendhilfe
    16 (2005) 273–279.
date_created: 2024-01-19T09:21:54Z
date_updated: 2026-04-14T09:11:25Z
department:
- _id: '582'
extern: '1'
intvolume: '        16'
language:
- iso: ger
page: 273–279
publication: Zeitschrift für Jugendkriminalrecht und Jugendhilfe
publication_status: published
status: public
title: Freizeitverhalten und Drogenkonsum von Schülern der Schule für Erziehungshilfe
  und Lernbehinderte
type: journal_article
user_id: '26628'
volume: 16
year: '2005'
...
---
_id: '13719'
author:
- first_name: K.
  full_name: Seino, K.
  last_name: Seino
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: F.
  full_name: Bechstedt, F.
  last_name: Bechstedt
citation:
  ama: Seino K, Schmidt WG, Bechstedt F. Organic modification of surface electronic
    properties: A first-principles study of uracil on Si(001). <i>Physical Review
    B</i>. 2004;69:245309. doi:<a href="https://doi.org/10.1103/physrevb.69.245309">10.1103/physrevb.69.245309</a>
  apa: Seino, K., Schmidt, W. G., &#38; Bechstedt, F. (2004). Organic modification
    of surface electronic properties: A first-principles study of uracil on Si(001).
    <i>Physical Review B</i>, <i>69</i>, 245309. <a href="https://doi.org/10.1103/physrevb.69.245309">https://doi.org/10.1103/physrevb.69.245309</a>
  bibtex: '@article{Seino_Schmidt_Bechstedt_2004, title={Organic modification of surface
    electronic properties: A first-principles study of uracil on Si(001)}, volume={69},
    DOI={<a href="https://doi.org/10.1103/physrevb.69.245309">10.1103/physrevb.69.245309</a>},
    journal={Physical Review B}, author={Seino, K. and Schmidt, Wolf Gero and Bechstedt,
    F.}, year={2004}, pages={245309} }'
  chicago: 'Seino, K., Wolf Gero Schmidt, and F. Bechstedt. “Organic Modification
    of Surface Electronic Properties: A First-Principles Study of Uracil on Si(001).”
    <i>Physical Review B</i> 69 (2004): 245309. <a href="https://doi.org/10.1103/physrevb.69.245309">https://doi.org/10.1103/physrevb.69.245309</a>.'
  ieee: 'K. Seino, W. G. Schmidt, and F. Bechstedt, “Organic modification of surface
    electronic properties: A first-principles study of uracil on Si(001),” <i>Physical
    Review B</i>, vol. 69, p. 245309, 2004, doi: <a href="https://doi.org/10.1103/physrevb.69.245309">10.1103/physrevb.69.245309</a>.'
  mla: Seino, K., et al. “Organic Modification of Surface Electronic Properties: A
    First-Principles Study of Uracil on Si(001).” <i>Physical Review B</i>, vol. 69,
    2004, p. 245309, doi:<a href="https://doi.org/10.1103/physrevb.69.245309">10.1103/physrevb.69.245309</a>.
  short: K. Seino, W.G. Schmidt, F. Bechstedt, Physical Review B 69 (2004) 245309.
date_created: 2019-10-09T12:29:58Z
date_updated: 2025-12-05T13:13:35Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
doi: 10.1103/physrevb.69.245309
funded_apc: '1'
intvolume: '        69'
language:
- iso: eng
page: '245309'
publication: Physical Review B
publication_identifier:
  issn:
  - 1098-0121
  - 1550-235X
publication_status: published
status: public
title: Organic modification of surface electronic properties: A first-principles study
  of uracil on Si(001)
type: journal_article
user_id: '16199'
volume: 69
year: '2004'
...
---
_id: '13712'
author:
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: F
  full_name: Fuchs, F
  last_name: Fuchs
- first_name: A
  full_name: Hermann, A
  last_name: Hermann
- first_name: K
  full_name: Seino, K
  last_name: Seino
- first_name: F
  full_name: Bechstedt, F
  last_name: Bechstedt
- first_name: R
  full_name: Paßmann, R
  last_name: Paßmann
- first_name: M
  full_name: Wahl, M
  last_name: Wahl
- first_name: M
  full_name: Gensch, M
  last_name: Gensch
- first_name: K
  full_name: Hinrichs, K
  last_name: Hinrichs
- first_name: N
  full_name: Esser, N
  last_name: Esser
- first_name: S
  full_name: Wang, S
  last_name: Wang
- first_name: W
  full_name: Lu, W
  last_name: Lu
- first_name: J
  full_name: Bernholc, J
  last_name: Bernholc
citation:
  ama: 'Schmidt WG, Fuchs F, Hermann A, et al. Oxidation- and organic-molecule-induced
    changes of the Si surface optical anisotropy:ab initiopredictions. <i>Journal
    of Physics: Condensed Matter</i>. 2004;16:S4323-S4334. doi:<a href="https://doi.org/10.1088/0953-8984/16/39/007">10.1088/0953-8984/16/39/007</a>'
  apa: 'Schmidt, W. G., Fuchs, F., Hermann, A., Seino, K., Bechstedt, F., Paßmann,
    R., Wahl, M., Gensch, M., Hinrichs, K., Esser, N., Wang, S., Lu, W., &#38; Bernholc,
    J. (2004). Oxidation- and organic-molecule-induced changes of the Si surface optical
    anisotropy:ab initiopredictions. <i>Journal of Physics: Condensed Matter</i>,
    <i>16</i>, S4323–S4334. <a href="https://doi.org/10.1088/0953-8984/16/39/007">https://doi.org/10.1088/0953-8984/16/39/007</a>'
  bibtex: '@article{Schmidt_Fuchs_Hermann_Seino_Bechstedt_Paßmann_Wahl_Gensch_Hinrichs_Esser_et
    al._2004, title={Oxidation- and organic-molecule-induced changes of the Si surface
    optical anisotropy:ab initiopredictions}, volume={16}, DOI={<a href="https://doi.org/10.1088/0953-8984/16/39/007">10.1088/0953-8984/16/39/007</a>},
    journal={Journal of Physics: Condensed Matter}, author={Schmidt, Wolf Gero and
    Fuchs, F and Hermann, A and Seino, K and Bechstedt, F and Paßmann, R and Wahl,
    M and Gensch, M and Hinrichs, K and Esser, N and et al.}, year={2004}, pages={S4323–S4334}
    }'
  chicago: 'Schmidt, Wolf Gero, F Fuchs, A Hermann, K Seino, F Bechstedt, R Paßmann,
    M Wahl, et al. “Oxidation- and Organic-Molecule-Induced Changes of the Si Surface
    Optical Anisotropy:Ab Initiopredictions.” <i>Journal of Physics: Condensed Matter</i>
    16 (2004): S4323–34. <a href="https://doi.org/10.1088/0953-8984/16/39/007">https://doi.org/10.1088/0953-8984/16/39/007</a>.'
  ieee: 'W. G. Schmidt <i>et al.</i>, “Oxidation- and organic-molecule-induced changes
    of the Si surface optical anisotropy:ab initiopredictions,” <i>Journal of Physics:
    Condensed Matter</i>, vol. 16, pp. S4323–S4334, 2004, doi: <a href="https://doi.org/10.1088/0953-8984/16/39/007">10.1088/0953-8984/16/39/007</a>.'
  mla: 'Schmidt, Wolf Gero, et al. “Oxidation- and Organic-Molecule-Induced Changes
    of the Si Surface Optical Anisotropy:Ab Initiopredictions.” <i>Journal of Physics:
    Condensed Matter</i>, vol. 16, 2004, pp. S4323–34, doi:<a href="https://doi.org/10.1088/0953-8984/16/39/007">10.1088/0953-8984/16/39/007</a>.'
  short: 'W.G. Schmidt, F. Fuchs, A. Hermann, K. Seino, F. Bechstedt, R. Paßmann,
    M. Wahl, M. Gensch, K. Hinrichs, N. Esser, S. Wang, W. Lu, J. Bernholc, Journal
    of Physics: Condensed Matter 16 (2004) S4323–S4334.'
date_created: 2019-10-09T12:12:44Z
date_updated: 2025-12-05T13:15:13Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
doi: 10.1088/0953-8984/16/39/007
funded_apc: '1'
intvolume: '        16'
language:
- iso: eng
page: S4323-S4334
publication: 'Journal of Physics: Condensed Matter'
publication_identifier:
  issn:
  - 0953-8984
  - 1361-648X
publication_status: published
status: public
title: Oxidation- and organic-molecule-induced changes of the Si surface optical anisotropy:ab
  initiopredictions
type: journal_article
user_id: '16199'
volume: 16
year: '2004'
...
---
_id: '13716'
author:
- first_name: K
  full_name: Fleischer, K
  last_name: Fleischer
- first_name: S
  full_name: Chandola, S
  last_name: Chandola
- first_name: N
  full_name: Esser, N
  last_name: Esser
- first_name: W
  full_name: Richter, W
  last_name: Richter
- first_name: J.F
  full_name: McGilp, J.F
  last_name: McGilp
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: S
  full_name: Wang, S
  last_name: Wang
- first_name: W
  full_name: Lu, W
  last_name: Lu
- first_name: J
  full_name: Bernholc, J
  last_name: Bernholc
citation:
  ama: 'Fleischer K, Chandola S, Esser N, et al. Atomic indium nanowires on Si(111):
    the (4 × 1)–(8 × 2) phase transition studied with reflectance anisotropy spectroscopy.
    <i>Applied Surface Science</i>. 2004;234:302-306. doi:<a href="https://doi.org/10.1016/j.apsusc.2004.05.114">10.1016/j.apsusc.2004.05.114</a>'
  apa: 'Fleischer, K., Chandola, S., Esser, N., Richter, W., McGilp, J. F., Schmidt,
    W. G., Wang, S., Lu, W., &#38; Bernholc, J. (2004). Atomic indium nanowires on
    Si(111): the (4 × 1)–(8 × 2) phase transition studied with reflectance anisotropy
    spectroscopy. <i>Applied Surface Science</i>, <i>234</i>, 302–306. <a href="https://doi.org/10.1016/j.apsusc.2004.05.114">https://doi.org/10.1016/j.apsusc.2004.05.114</a>'
  bibtex: '@article{Fleischer_Chandola_Esser_Richter_McGilp_Schmidt_Wang_Lu_Bernholc_2004,
    title={Atomic indium nanowires on Si(111): the (4 × 1)–(8 × 2) phase transition
    studied with reflectance anisotropy spectroscopy}, volume={234}, DOI={<a href="https://doi.org/10.1016/j.apsusc.2004.05.114">10.1016/j.apsusc.2004.05.114</a>},
    journal={Applied Surface Science}, author={Fleischer, K and Chandola, S and Esser,
    N and Richter, W and McGilp, J.F and Schmidt, Wolf Gero and Wang, S and Lu, W
    and Bernholc, J}, year={2004}, pages={302–306} }'
  chicago: 'Fleischer, K, S Chandola, N Esser, W Richter, J.F McGilp, Wolf Gero Schmidt,
    S Wang, W Lu, and J Bernholc. “Atomic Indium Nanowires on Si(111): The (4 × 1)–(8
    × 2) Phase Transition Studied with Reflectance Anisotropy Spectroscopy.” <i>Applied
    Surface Science</i> 234 (2004): 302–6. <a href="https://doi.org/10.1016/j.apsusc.2004.05.114">https://doi.org/10.1016/j.apsusc.2004.05.114</a>.'
  ieee: 'K. Fleischer <i>et al.</i>, “Atomic indium nanowires on Si(111): the (4 ×
    1)–(8 × 2) phase transition studied with reflectance anisotropy spectroscopy,”
    <i>Applied Surface Science</i>, vol. 234, pp. 302–306, 2004, doi: <a href="https://doi.org/10.1016/j.apsusc.2004.05.114">10.1016/j.apsusc.2004.05.114</a>.'
  mla: 'Fleischer, K., et al. “Atomic Indium Nanowires on Si(111): The (4 × 1)–(8
    × 2) Phase Transition Studied with Reflectance Anisotropy Spectroscopy.” <i>Applied
    Surface Science</i>, vol. 234, 2004, pp. 302–06, doi:<a href="https://doi.org/10.1016/j.apsusc.2004.05.114">10.1016/j.apsusc.2004.05.114</a>.'
  short: K. Fleischer, S. Chandola, N. Esser, W. Richter, J.F. McGilp, W.G. Schmidt,
    S. Wang, W. Lu, J. Bernholc, Applied Surface Science 234 (2004) 302–306.
date_created: 2019-10-09T12:26:23Z
date_updated: 2025-12-05T13:14:56Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
doi: 10.1016/j.apsusc.2004.05.114
funded_apc: '1'
intvolume: '       234'
language:
- iso: eng
page: 302-306
publication: Applied Surface Science
publication_identifier:
  issn:
  - 0169-4332
publication_status: published
status: public
title: 'Atomic indium nanowires on Si(111): the (4 × 1)–(8 × 2) phase transition studied
  with reflectance anisotropy spectroscopy'
type: journal_article
user_id: '16199'
volume: 234
year: '2004'
...
---
_id: '13713'
author:
- first_name: M
  full_name: Palummo, M
  last_name: Palummo
- first_name: O
  full_name: Pulci, O
  last_name: Pulci
- first_name: R Del
  full_name: Sole, R Del
  last_name: Sole
- first_name: A
  full_name: Marini, A
  last_name: Marini
- first_name: P
  full_name: Hahn, P
  last_name: Hahn
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: F
  full_name: Bechstedt, F
  last_name: Bechstedt
citation:
  ama: 'Palummo M, Pulci O, Sole RD, et al. The Bethe–Salpeter equation: a first-principles
    approach for calculating surface optical spectra. <i>Journal of Physics: Condensed
    Matter</i>. 2004;16:S4313-S4322. doi:<a href="https://doi.org/10.1088/0953-8984/16/39/006">10.1088/0953-8984/16/39/006</a>'
  apa: 'Palummo, M., Pulci, O., Sole, R. D., Marini, A., Hahn, P., Schmidt, W. G.,
    &#38; Bechstedt, F. (2004). The Bethe–Salpeter equation: a first-principles approach
    for calculating surface optical spectra. <i>Journal of Physics: Condensed Matter</i>,
    <i>16</i>, S4313–S4322. <a href="https://doi.org/10.1088/0953-8984/16/39/006">https://doi.org/10.1088/0953-8984/16/39/006</a>'
  bibtex: '@article{Palummo_Pulci_Sole_Marini_Hahn_Schmidt_Bechstedt_2004, title={The
    Bethe–Salpeter equation: a first-principles approach for calculating surface optical
    spectra}, volume={16}, DOI={<a href="https://doi.org/10.1088/0953-8984/16/39/006">10.1088/0953-8984/16/39/006</a>},
    journal={Journal of Physics: Condensed Matter}, author={Palummo, M and Pulci,
    O and Sole, R Del and Marini, A and Hahn, P and Schmidt, Wolf Gero and Bechstedt,
    F}, year={2004}, pages={S4313–S4322} }'
  chicago: 'Palummo, M, O Pulci, R Del Sole, A Marini, P Hahn, Wolf Gero Schmidt,
    and F Bechstedt. “The Bethe–Salpeter Equation: A First-Principles Approach for
    Calculating Surface Optical Spectra.” <i>Journal of Physics: Condensed Matter</i>
    16 (2004): S4313–22. <a href="https://doi.org/10.1088/0953-8984/16/39/006">https://doi.org/10.1088/0953-8984/16/39/006</a>.'
  ieee: 'M. Palummo <i>et al.</i>, “The Bethe–Salpeter equation: a first-principles
    approach for calculating surface optical spectra,” <i>Journal of Physics: Condensed
    Matter</i>, vol. 16, pp. S4313–S4322, 2004, doi: <a href="https://doi.org/10.1088/0953-8984/16/39/006">10.1088/0953-8984/16/39/006</a>.'
  mla: 'Palummo, M., et al. “The Bethe–Salpeter Equation: A First-Principles Approach
    for Calculating Surface Optical Spectra.” <i>Journal of Physics: Condensed Matter</i>,
    vol. 16, 2004, pp. S4313–22, doi:<a href="https://doi.org/10.1088/0953-8984/16/39/006">10.1088/0953-8984/16/39/006</a>.'
  short: 'M. Palummo, O. Pulci, R.D. Sole, A. Marini, P. Hahn, W.G. Schmidt, F. Bechstedt,
    Journal of Physics: Condensed Matter 16 (2004) S4313–S4322.'
date_created: 2019-10-09T12:13:53Z
date_updated: 2025-12-05T13:15:31Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
doi: 10.1088/0953-8984/16/39/006
funded_apc: '1'
intvolume: '        16'
language:
- iso: eng
page: S4313-S4322
publication: 'Journal of Physics: Condensed Matter'
publication_identifier:
  issn:
  - 0953-8984
  - 1361-648X
publication_status: published
status: public
title: 'The Bethe–Salpeter equation: a first-principles approach for calculating surface
  optical spectra'
type: journal_article
user_id: '16199'
volume: 16
year: '2004'
...
---
_id: '13710'
author:
- first_name: Akihiro
  full_name: Ohtake, Akihiro
  last_name: Ohtake
- first_name: Pavel
  full_name: Kocán, Pavel
  last_name: Kocán
- first_name: Kaori
  full_name: Seino, Kaori
  last_name: Seino
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: Nobuyuki
  full_name: Koguchi, Nobuyuki
  last_name: Koguchi
citation:
  ama: 'Ohtake A, Kocán P, Seino K, Schmidt WG, Koguchi N. Ga-Rich Limit of Surface
    Reconstructions on GaAs(001): Atomic Structure of the(4×6)Phase. <i>Physical Review
    Letters</i>. 2004;93:266101. doi:<a href="https://doi.org/10.1103/physrevlett.93.266101">10.1103/physrevlett.93.266101</a>'
  apa: 'Ohtake, A., Kocán, P., Seino, K., Schmidt, W. G., &#38; Koguchi, N. (2004).
    Ga-Rich Limit of Surface Reconstructions on GaAs(001): Atomic Structure of the(4×6)Phase.
    <i>Physical Review Letters</i>, <i>93</i>, 266101. <a href="https://doi.org/10.1103/physrevlett.93.266101">https://doi.org/10.1103/physrevlett.93.266101</a>'
  bibtex: '@article{Ohtake_Kocán_Seino_Schmidt_Koguchi_2004, title={Ga-Rich Limit
    of Surface Reconstructions on GaAs(001): Atomic Structure of the(4×6)Phase}, volume={93},
    DOI={<a href="https://doi.org/10.1103/physrevlett.93.266101">10.1103/physrevlett.93.266101</a>},
    journal={Physical Review Letters}, author={Ohtake, Akihiro and Kocán, Pavel and
    Seino, Kaori and Schmidt, Wolf Gero and Koguchi, Nobuyuki}, year={2004}, pages={266101}
    }'
  chicago: 'Ohtake, Akihiro, Pavel Kocán, Kaori Seino, Wolf Gero Schmidt, and Nobuyuki
    Koguchi. “Ga-Rich Limit of Surface Reconstructions on GaAs(001): Atomic Structure
    of the(4×6)Phase.” <i>Physical Review Letters</i> 93 (2004): 266101. <a href="https://doi.org/10.1103/physrevlett.93.266101">https://doi.org/10.1103/physrevlett.93.266101</a>.'
  ieee: 'A. Ohtake, P. Kocán, K. Seino, W. G. Schmidt, and N. Koguchi, “Ga-Rich Limit
    of Surface Reconstructions on GaAs(001): Atomic Structure of the(4×6)Phase,” <i>Physical
    Review Letters</i>, vol. 93, p. 266101, 2004, doi: <a href="https://doi.org/10.1103/physrevlett.93.266101">10.1103/physrevlett.93.266101</a>.'
  mla: 'Ohtake, Akihiro, et al. “Ga-Rich Limit of Surface Reconstructions on GaAs(001):
    Atomic Structure of the(4×6)Phase.” <i>Physical Review Letters</i>, vol. 93, 2004,
    p. 266101, doi:<a href="https://doi.org/10.1103/physrevlett.93.266101">10.1103/physrevlett.93.266101</a>.'
  short: A. Ohtake, P. Kocán, K. Seino, W.G. Schmidt, N. Koguchi, Physical Review
    Letters 93 (2004) 266101.
date_created: 2019-10-09T12:10:16Z
date_updated: 2025-12-05T13:16:03Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
doi: 10.1103/physrevlett.93.266101
intvolume: '        93'
language:
- iso: eng
page: '266101'
publication: Physical Review Letters
publication_identifier:
  issn:
  - 0031-9007
  - 1079-7114
publication_status: published
status: public
title: 'Ga-Rich Limit of Surface Reconstructions on GaAs(001): Atomic Structure of
  the(4×6)Phase'
type: journal_article
user_id: '16199'
volume: 93
year: '2004'
...
---
_id: '13717'
author:
- first_name: K.
  full_name: Seino, K.
  last_name: Seino
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: F.
  full_name: Bechstedt, F.
  last_name: Bechstedt
citation:
  ama: Seino K, Schmidt WG, Bechstedt F. Energetics of Si(001) Surfaces Exposed to
    Electric Fields and Charge Injection. <i>Physical Review Letters</i>. 2004;93(3).
    doi:<a href="https://doi.org/10.1103/physrevlett.93.036101">10.1103/physrevlett.93.036101</a>
  apa: Seino, K., Schmidt, W. G., &#38; Bechstedt, F. (2004). Energetics of Si(001)
    Surfaces Exposed to Electric Fields and Charge Injection. <i>Physical Review Letters</i>,
    <i>93</i>(3). <a href="https://doi.org/10.1103/physrevlett.93.036101">https://doi.org/10.1103/physrevlett.93.036101</a>
  bibtex: '@article{Seino_Schmidt_Bechstedt_2004, title={Energetics of Si(001) Surfaces
    Exposed to Electric Fields and Charge Injection}, volume={93}, DOI={<a href="https://doi.org/10.1103/physrevlett.93.036101">10.1103/physrevlett.93.036101</a>},
    number={3}, journal={Physical Review Letters}, author={Seino, K. and Schmidt,
    Wolf Gero and Bechstedt, F.}, year={2004} }'
  chicago: Seino, K., Wolf Gero Schmidt, and F. Bechstedt. “Energetics of Si(001)
    Surfaces Exposed to Electric Fields and Charge Injection.” <i>Physical Review
    Letters</i> 93, no. 3 (2004). <a href="https://doi.org/10.1103/physrevlett.93.036101">https://doi.org/10.1103/physrevlett.93.036101</a>.
  ieee: 'K. Seino, W. G. Schmidt, and F. Bechstedt, “Energetics of Si(001) Surfaces
    Exposed to Electric Fields and Charge Injection,” <i>Physical Review Letters</i>,
    vol. 93, no. 3, 2004, doi: <a href="https://doi.org/10.1103/physrevlett.93.036101">10.1103/physrevlett.93.036101</a>.'
  mla: Seino, K., et al. “Energetics of Si(001) Surfaces Exposed to Electric Fields
    and Charge Injection.” <i>Physical Review Letters</i>, vol. 93, no. 3, 2004, doi:<a
    href="https://doi.org/10.1103/physrevlett.93.036101">10.1103/physrevlett.93.036101</a>.
  short: K. Seino, W.G. Schmidt, F. Bechstedt, Physical Review Letters 93 (2004).
date_created: 2019-10-09T12:27:47Z
date_updated: 2025-12-05T13:14:40Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
doi: 10.1103/physrevlett.93.036101
funded_apc: '1'
intvolume: '        93'
issue: '3'
language:
- iso: eng
publication: Physical Review Letters
publication_identifier:
  issn:
  - 0031-9007
  - 1079-7114
publication_status: published
status: public
title: Energetics of Si(001) Surfaces Exposed to Electric Fields and Charge Injection
type: journal_article
user_id: '16199'
volume: 93
year: '2004'
...
