---
_id: '11989'
author:
- first_name: Claudia
  full_name: Campolo, Claudia
  last_name: Campolo
- first_name: Lin
  full_name: Cheng, Lin
  last_name: Cheng
- first_name: Christoph
  full_name: Sommer, Christoph
  id: '49154'
  last_name: Sommer
  orcid: 0000-0002-4336-7350
- first_name: Hsin-Mu
  full_name: Tsai, Hsin-Mu
  last_name: Tsai
citation:
  ama: Campolo C, Cheng L, Sommer C, Tsai H-M. Special Issue on Multi-radio, Multi-technology,
    Multi-system Vehicular Communications. <i>Computer Communications</i>. Published
    online 2016:1-2. doi:<a href="https://doi.org/10.1016/j.comcom.2016.09.003">10.1016/j.comcom.2016.09.003</a>
  apa: Campolo, C., Cheng, L., Sommer, C., &#38; Tsai, H.-M. (2016). Special Issue
    on Multi-radio, Multi-technology, Multi-system Vehicular Communications. <i>Computer
    Communications</i>, 1–2. <a href="https://doi.org/10.1016/j.comcom.2016.09.003">https://doi.org/10.1016/j.comcom.2016.09.003</a>
  bibtex: '@article{Campolo_Cheng_Sommer_Tsai_2016, title={Special Issue on Multi-radio,
    Multi-technology, Multi-system Vehicular Communications}, DOI={<a href="https://doi.org/10.1016/j.comcom.2016.09.003">10.1016/j.comcom.2016.09.003</a>},
    journal={Computer Communications}, author={Campolo, Claudia and Cheng, Lin and
    Sommer, Christoph and Tsai, Hsin-Mu}, year={2016}, pages={1–2} }'
  chicago: Campolo, Claudia, Lin Cheng, Christoph Sommer, and Hsin-Mu Tsai. “Special
    Issue on Multi-Radio, Multi-Technology, Multi-System Vehicular Communications.”
    <i>Computer Communications</i>, 2016, 1–2. <a href="https://doi.org/10.1016/j.comcom.2016.09.003">https://doi.org/10.1016/j.comcom.2016.09.003</a>.
  ieee: 'C. Campolo, L. Cheng, C. Sommer, and H.-M. Tsai, “Special Issue on Multi-radio,
    Multi-technology, Multi-system Vehicular Communications,” <i>Computer Communications</i>,
    pp. 1–2, 2016, doi: <a href="https://doi.org/10.1016/j.comcom.2016.09.003">10.1016/j.comcom.2016.09.003</a>.'
  mla: Campolo, Claudia, et al. “Special Issue on Multi-Radio, Multi-Technology, Multi-System
    Vehicular Communications.” <i>Computer Communications</i>, 2016, pp. 1–2, doi:<a
    href="https://doi.org/10.1016/j.comcom.2016.09.003">10.1016/j.comcom.2016.09.003</a>.
  short: C. Campolo, L. Cheng, C. Sommer, H.-M. Tsai, Computer Communications (2016)
    1–2.
date_created: 2019-07-18T09:51:59Z
date_updated: 2026-03-10T09:33:08Z
department:
- _id: '589'
doi: 10.1016/j.comcom.2016.09.003
language:
- iso: eng
page: 1-2
publication: Computer Communications
publication_identifier:
  issn:
  - 0140-3664
publication_status: published
status: public
title: Special Issue on Multi-radio, Multi-technology, Multi-system Vehicular Communications
type: journal_article
user_id: '14972'
year: '2016'
...
---
_id: '61494'
author:
- first_name: Katrin
  full_name: König, Katrin
  id: '118819'
  last_name: König
citation:
  ama: König K. <i>Begnadete Freiheit. Anselm von Canterburys Freiheitstheorie</i>.
    Mohr Siebeck; 2016. doi:<a href="https://doi.org/10.1628/978-3-16-154385-2">10.1628/978-3-16-154385-2</a>
  apa: König, K. (2016). <i>Begnadete Freiheit. Anselm von Canterburys Freiheitstheorie</i>.
    Mohr Siebeck. <a href="https://doi.org/10.1628/978-3-16-154385-2">https://doi.org/10.1628/978-3-16-154385-2</a>
  bibtex: '@book{König_2016, place={Tübingen}, title={Begnadete Freiheit. Anselm von
    Canterburys Freiheitstheorie}, DOI={<a href="https://doi.org/10.1628/978-3-16-154385-2">10.1628/978-3-16-154385-2</a>},
    publisher={Mohr Siebeck}, author={König, Katrin}, year={2016} }'
  chicago: 'König, Katrin. <i>Begnadete Freiheit. Anselm von Canterburys Freiheitstheorie</i>.
    Tübingen: Mohr Siebeck, 2016. <a href="https://doi.org/10.1628/978-3-16-154385-2">https://doi.org/10.1628/978-3-16-154385-2</a>.'
  ieee: 'K. König, <i>Begnadete Freiheit. Anselm von Canterburys Freiheitstheorie</i>.
    Tübingen: Mohr Siebeck, 2016.'
  mla: König, Katrin. <i>Begnadete Freiheit. Anselm von Canterburys Freiheitstheorie</i>.
    Mohr Siebeck, 2016, doi:<a href="https://doi.org/10.1628/978-3-16-154385-2">10.1628/978-3-16-154385-2</a>.
  short: K. König, Begnadete Freiheit. Anselm von Canterburys Freiheitstheorie, Mohr
    Siebeck, Tübingen, 2016.
date_created: 2025-10-02T07:12:32Z
date_updated: 2025-10-02T09:53:19Z
department:
- _id: '20'
doi: 10.1628/978-3-16-154385-2
extern: '1'
language:
- iso: eng
place: Tübingen
publisher: Mohr Siebeck
status: public
title: Begnadete Freiheit. Anselm von Canterburys Freiheitstheorie
type: dissertation
user_id: '118819'
year: '2016'
...
---
_id: '29613'
author:
- first_name: Oliver
  full_name: Wallscheid, Oliver
  id: '11291'
  last_name: Wallscheid
  orcid: https://orcid.org/0000-0001-9362-8777
- first_name: Tobias
  full_name: Huber, Tobias
  last_name: Huber
- first_name: Wilhelm
  full_name: Peters, Wilhelm
  last_name: Peters
- first_name: Joachim
  full_name: Böcker, Joachim
  id: '66'
  last_name: Böcker
  orcid: 0000-0002-8480-7295
citation:
  ama: Wallscheid O, Huber T, Peters W, Böcker J. A Critical Review of Techniques
    to Determine the Magnet Temperature of Permanent Magnet Synchronous Motors under
    Real-time Conditions. <i>EPE Journal</i>. 2016;(25):1–10. doi:<a href="https://doi.org/10.1080/09398368.2016.1209877">10.1080/09398368.2016.1209877</a>
  apa: Wallscheid, O., Huber, T., Peters, W., &#38; Böcker, J. (2016). A Critical
    Review of Techniques to Determine the Magnet Temperature of Permanent Magnet Synchronous
    Motors under Real-time Conditions. <i>EPE Journal</i>, <i>25</i>, 1–10. <a href="https://doi.org/10.1080/09398368.2016.1209877">https://doi.org/10.1080/09398368.2016.1209877</a>
  bibtex: '@article{Wallscheid_Huber_Peters_Böcker_2016, title={A Critical Review
    of Techniques to Determine the Magnet Temperature of Permanent Magnet Synchronous
    Motors under Real-time Conditions}, DOI={<a href="https://doi.org/10.1080/09398368.2016.1209877">10.1080/09398368.2016.1209877</a>},
    number={25}, journal={EPE Journal}, publisher={Taylor &#38; Francis}, author={Wallscheid,
    Oliver and Huber, Tobias and Peters, Wilhelm and Böcker, Joachim}, year={2016},
    pages={1–10} }'
  chicago: 'Wallscheid, Oliver, Tobias Huber, Wilhelm Peters, and Joachim Böcker.
    “A Critical Review of Techniques to Determine the Magnet Temperature of Permanent
    Magnet Synchronous Motors under Real-Time Conditions.” <i>EPE Journal</i>, no.
    25 (2016): 1–10. <a href="https://doi.org/10.1080/09398368.2016.1209877">https://doi.org/10.1080/09398368.2016.1209877</a>.'
  ieee: 'O. Wallscheid, T. Huber, W. Peters, and J. Böcker, “A Critical Review of
    Techniques to Determine the Magnet Temperature of Permanent Magnet Synchronous
    Motors under Real-time Conditions,” <i>EPE Journal</i>, no. 25, pp. 1–10, 2016,
    doi: <a href="https://doi.org/10.1080/09398368.2016.1209877">10.1080/09398368.2016.1209877</a>.'
  mla: Wallscheid, Oliver, et al. “A Critical Review of Techniques to Determine the
    Magnet Temperature of Permanent Magnet Synchronous Motors under Real-Time Conditions.”
    <i>EPE Journal</i>, no. 25, Taylor &#38; Francis, 2016, pp. 1–10, doi:<a href="https://doi.org/10.1080/09398368.2016.1209877">10.1080/09398368.2016.1209877</a>.
  short: O. Wallscheid, T. Huber, W. Peters, J. Böcker, EPE Journal (2016) 1–10.
date_created: 2022-01-28T14:10:55Z
date_updated: 2025-10-03T16:40:19Z
department:
- _id: '52'
doi: 10.1080/09398368.2016.1209877
issue: '25'
language:
- iso: eng
main_file_link:
- url: https://www.researchgate.net/publication/305764079_A_critical_review_of_techniques_to_determine_the_magnet_temperature_of_permanent_magnet_synchronous_motors_under_real-time_conditions
page: 1–10
publication: EPE Journal
publisher: Taylor & Francis
status: public
title: A Critical Review of Techniques to Determine the Magnet Temperature of Permanent
  Magnet Synchronous Motors under Real-time Conditions
type: journal_article
user_id: '66'
year: '2016'
...
---
_id: '61806'
article_number: e0157506
author:
- first_name: Maxi
  full_name: Robinski, Maxi
  last_name: Robinski
- first_name: Franz
  full_name: Strich, Franz
  id: '122631'
  last_name: Strich
  orcid: 0000-0002-0170-9025
- first_name: Wilfried
  full_name: Mau, Wilfried
  last_name: Mau
- first_name: Matthias
  full_name: Girndt, Matthias
  last_name: Girndt
citation:
  ama: Robinski M, Strich F, Mau W, Girndt M. Validating a Patient-Reported Comorbidity
    Measure with Respect to Quality of Life in End-Stage Renal Disease. <i>PLOS ONE</i>.
    2016;11(6). doi:<a href="https://doi.org/10.1371/journal.pone.0157506">10.1371/journal.pone.0157506</a>
  apa: Robinski, M., Strich, F., Mau, W., &#38; Girndt, M. (2016). Validating a Patient-Reported
    Comorbidity Measure with Respect to Quality of Life in End-Stage Renal Disease.
    <i>PLOS ONE</i>, <i>11</i>(6), Article e0157506. <a href="https://doi.org/10.1371/journal.pone.0157506">https://doi.org/10.1371/journal.pone.0157506</a>
  bibtex: '@article{Robinski_Strich_Mau_Girndt_2016, title={Validating a Patient-Reported
    Comorbidity Measure with Respect to Quality of Life in End-Stage Renal Disease},
    volume={11}, DOI={<a href="https://doi.org/10.1371/journal.pone.0157506">10.1371/journal.pone.0157506</a>},
    number={6e0157506}, journal={PLOS ONE}, publisher={Public Library of Science (PLoS)},
    author={Robinski, Maxi and Strich, Franz and Mau, Wilfried and Girndt, Matthias},
    year={2016} }'
  chicago: Robinski, Maxi, Franz Strich, Wilfried Mau, and Matthias Girndt. “Validating
    a Patient-Reported Comorbidity Measure with Respect to Quality of Life in End-Stage
    Renal Disease.” <i>PLOS ONE</i> 11, no. 6 (2016). <a href="https://doi.org/10.1371/journal.pone.0157506">https://doi.org/10.1371/journal.pone.0157506</a>.
  ieee: 'M. Robinski, F. Strich, W. Mau, and M. Girndt, “Validating a Patient-Reported
    Comorbidity Measure with Respect to Quality of Life in End-Stage Renal Disease,”
    <i>PLOS ONE</i>, vol. 11, no. 6, Art. no. e0157506, 2016, doi: <a href="https://doi.org/10.1371/journal.pone.0157506">10.1371/journal.pone.0157506</a>.'
  mla: Robinski, Maxi, et al. “Validating a Patient-Reported Comorbidity Measure with
    Respect to Quality of Life in End-Stage Renal Disease.” <i>PLOS ONE</i>, vol.
    11, no. 6, e0157506, Public Library of Science (PLoS), 2016, doi:<a href="https://doi.org/10.1371/journal.pone.0157506">10.1371/journal.pone.0157506</a>.
  short: M. Robinski, F. Strich, W. Mau, M. Girndt, PLOS ONE 11 (2016).
date_created: 2025-10-13T11:43:50Z
date_updated: 2025-10-15T10:39:23Z
doi: 10.1371/journal.pone.0157506
intvolume: '        11'
issue: '6'
language:
- iso: eng
publication: PLOS ONE
publication_identifier:
  issn:
  - 1932-6203
publication_status: published
publisher: Public Library of Science (PLoS)
status: public
title: Validating a Patient-Reported Comorbidity Measure with Respect to Quality of
  Life in End-Stage Renal Disease
type: journal_article
user_id: '122631'
volume: 11
year: '2016'
...
---
_id: '37983'
abstract:
- lang: eng
  text: <p><bold>Taking Control!</bold>The binary catalyst system composed of MoO<sub>3</sub>and
    an organic phoshponium salt [Bu<sub>4</sub>P]X proved very efficient to produce
    oleochemical cyclic carbonates from renewables.</p>
author:
- first_name: Nils
  full_name: Tenhumberg, Nils
  last_name: Tenhumberg
- first_name: Hendrik
  full_name: Büttner, Hendrik
  last_name: Büttner
- first_name: Benjamin
  full_name: Schäffner, Benjamin
  last_name: Schäffner
- first_name: Daniela
  full_name: Kruse, Daniela
  last_name: Kruse
- first_name: Michael
  full_name: Blumenstein, Michael
  last_name: Blumenstein
- first_name: Thomas
  full_name: Werner, Thomas
  id: '89271'
  last_name: Werner
  orcid: 0000-0001-9025-3244
citation:
  ama: Tenhumberg N, Büttner H, Schäffner B, Kruse D, Blumenstein M, Werner T. Cooperative
    catalyst system for the synthesis of oleochemical cyclic carbonates from CO<sub>2</sub>and
    renewables. <i>Green Chemistry</i>. 2016;18(13):3775-3788. doi:<a href="https://doi.org/10.1039/c6gc00671j">10.1039/c6gc00671j</a>
  apa: Tenhumberg, N., Büttner, H., Schäffner, B., Kruse, D., Blumenstein, M., &#38;
    Werner, T. (2016). Cooperative catalyst system for the synthesis of oleochemical
    cyclic carbonates from CO<sub>2</sub>and renewables. <i>Green Chemistry</i>, <i>18</i>(13),
    3775–3788. <a href="https://doi.org/10.1039/c6gc00671j">https://doi.org/10.1039/c6gc00671j</a>
  bibtex: '@article{Tenhumberg_Büttner_Schäffner_Kruse_Blumenstein_Werner_2016, title={Cooperative
    catalyst system for the synthesis of oleochemical cyclic carbonates from CO<sub>2</sub>and
    renewables}, volume={18}, DOI={<a href="https://doi.org/10.1039/c6gc00671j">10.1039/c6gc00671j</a>},
    number={13}, journal={Green Chemistry}, publisher={Royal Society of Chemistry
    (RSC)}, author={Tenhumberg, Nils and Büttner, Hendrik and Schäffner, Benjamin
    and Kruse, Daniela and Blumenstein, Michael and Werner, Thomas}, year={2016},
    pages={3775–3788} }'
  chicago: 'Tenhumberg, Nils, Hendrik Büttner, Benjamin Schäffner, Daniela Kruse,
    Michael Blumenstein, and Thomas Werner. “Cooperative Catalyst System for the Synthesis
    of Oleochemical Cyclic Carbonates from CO<sub>2</sub>and Renewables.” <i>Green
    Chemistry</i> 18, no. 13 (2016): 3775–88. <a href="https://doi.org/10.1039/c6gc00671j">https://doi.org/10.1039/c6gc00671j</a>.'
  ieee: 'N. Tenhumberg, H. Büttner, B. Schäffner, D. Kruse, M. Blumenstein, and T.
    Werner, “Cooperative catalyst system for the synthesis of oleochemical cyclic
    carbonates from CO<sub>2</sub>and renewables,” <i>Green Chemistry</i>, vol. 18,
    no. 13, pp. 3775–3788, 2016, doi: <a href="https://doi.org/10.1039/c6gc00671j">10.1039/c6gc00671j</a>.'
  mla: Tenhumberg, Nils, et al. “Cooperative Catalyst System for the Synthesis of
    Oleochemical Cyclic Carbonates from CO<sub>2</sub>and Renewables.” <i>Green Chemistry</i>,
    vol. 18, no. 13, Royal Society of Chemistry (RSC), 2016, pp. 3775–88, doi:<a href="https://doi.org/10.1039/c6gc00671j">10.1039/c6gc00671j</a>.
  short: N. Tenhumberg, H. Büttner, B. Schäffner, D. Kruse, M. Blumenstein, T. Werner,
    Green Chemistry 18 (2016) 3775–3788.
date_created: 2023-01-22T21:03:02Z
date_updated: 2025-11-10T09:20:35Z
department:
- _id: '35'
- _id: '2'
- _id: '657'
doi: 10.1039/c6gc00671j
extern: '1'
intvolume: '        18'
issue: '13'
keyword:
- T1
- T3
- CSSD
language:
- iso: eng
page: 3775-3788
publication: Green Chemistry
publication_identifier:
  issn:
  - 1463-9262
  - 1463-9270
publication_status: published
publisher: Royal Society of Chemistry (RSC)
status: public
title: Cooperative catalyst system for the synthesis of oleochemical cyclic carbonates
  from CO<sub>2</sub>and renewables
type: journal_article
user_id: '89271'
volume: 18
year: '2016'
...
---
_id: '37989'
author:
- first_name: Marie-Luis
  full_name: Schirmer, Marie-Luis
  last_name: Schirmer
- first_name: Stefan
  full_name: Jopp, Stefan
  last_name: Jopp
- first_name: Jens
  full_name: Holz, Jens
  last_name: Holz
- first_name: Anke
  full_name: Spannenberg, Anke
  last_name: Spannenberg
- first_name: Thomas
  full_name: Werner, Thomas
  id: '89271'
  last_name: Werner
  orcid: 0000-0001-9025-3244
citation:
  ama: Schirmer M-L, Jopp S, Holz J, Spannenberg A, Werner T. Organocatalyzed Reduction
    of Tertiary Phosphine Oxides. <i>Advanced Synthesis and Catalysis</i>. 2016;358(1):26-29.
    doi:<a href="https://doi.org/10.1002/adsc.201500762">10.1002/adsc.201500762</a>
  apa: Schirmer, M.-L., Jopp, S., Holz, J., Spannenberg, A., &#38; Werner, T. (2016).
    Organocatalyzed Reduction of Tertiary Phosphine Oxides. <i>Advanced Synthesis
    and Catalysis</i>, <i>358</i>(1), 26–29. <a href="https://doi.org/10.1002/adsc.201500762">https://doi.org/10.1002/adsc.201500762</a>
  bibtex: '@article{Schirmer_Jopp_Holz_Spannenberg_Werner_2016, title={Organocatalyzed
    Reduction of Tertiary Phosphine Oxides}, volume={358}, DOI={<a href="https://doi.org/10.1002/adsc.201500762">10.1002/adsc.201500762</a>},
    number={1}, journal={Advanced Synthesis and Catalysis}, publisher={Wiley}, author={Schirmer,
    Marie-Luis and Jopp, Stefan and Holz, Jens and Spannenberg, Anke and Werner, Thomas},
    year={2016}, pages={26–29} }'
  chicago: 'Schirmer, Marie-Luis, Stefan Jopp, Jens Holz, Anke Spannenberg, and Thomas
    Werner. “Organocatalyzed Reduction of Tertiary Phosphine Oxides.” <i>Advanced
    Synthesis and Catalysis</i> 358, no. 1 (2016): 26–29. <a href="https://doi.org/10.1002/adsc.201500762">https://doi.org/10.1002/adsc.201500762</a>.'
  ieee: 'M.-L. Schirmer, S. Jopp, J. Holz, A. Spannenberg, and T. Werner, “Organocatalyzed
    Reduction of Tertiary Phosphine Oxides,” <i>Advanced Synthesis and Catalysis</i>,
    vol. 358, no. 1, pp. 26–29, 2016, doi: <a href="https://doi.org/10.1002/adsc.201500762">10.1002/adsc.201500762</a>.'
  mla: Schirmer, Marie-Luis, et al. “Organocatalyzed Reduction of Tertiary Phosphine
    Oxides.” <i>Advanced Synthesis and Catalysis</i>, vol. 358, no. 1, Wiley, 2016,
    pp. 26–29, doi:<a href="https://doi.org/10.1002/adsc.201500762">10.1002/adsc.201500762</a>.
  short: M.-L. Schirmer, S. Jopp, J. Holz, A. Spannenberg, T. Werner, Advanced Synthesis
    and Catalysis 358 (2016) 26–29.
date_created: 2023-01-22T21:05:14Z
date_updated: 2025-11-10T09:22:07Z
department:
- _id: '35'
- _id: '2'
- _id: '657'
doi: 10.1002/adsc.201500762
extern: '1'
intvolume: '       358'
issue: '1'
keyword:
- T2
- CSSD
language:
- iso: eng
page: 26-29
publication: Advanced Synthesis and Catalysis
publication_identifier:
  issn:
  - 1615-4150
publication_status: published
publisher: Wiley
status: public
title: Organocatalyzed Reduction of Tertiary Phosphine Oxides
type: journal_article
user_id: '89271'
volume: 358
year: '2016'
...
---
_id: '37984'
abstract:
- lang: eng
  text: <jats:p>The Wittig reaction is a fundamental transformation for the preparation
    of alkenes from carbonyl compounds and phosphonium ylides. The ylides are prepared
    prior to the olefination step from the respective phosphonium salts by deprotonation
    utilizing strong bases. A first free-base catalytic Wittig reaction for the preparation
    of highly functionalized alkenes was based on tributylphosphane as the catalyst.
    Subsequently we developed a system employing a phospholene oxide as a pre-catalyst
    and trimethoxysilane as reducing agent which operates under milder conditions.
    The title compounds, (<jats:italic>E</jats:italic>)-3-benzylidenepyrrolidine-2,5-dione,
    C<jats:sub>11</jats:sub>H<jats:sub>9</jats:sub>NO<jats:sub>2</jats:sub>, (I),
    the methylpyrrolidine derivative, C<jats:sub>12</jats:sub>H<jats:sub>11</jats:sub>NO<jats:sub>2</jats:sub>,
    (II), and the<jats:italic>tert-</jats:italic>butylpyrrolidine derivative, C<jats:sub>15</jats:sub>H<jats:sub>17</jats:sub>NO<jats:sub>2</jats:sub>,
    (III), have been synthesized by base-free catalytic Wittig reactions. In the crystal
    of (I), molecules are linked into centrosymmetric dimers<jats:italic>via</jats:italic>pairs
    of N—H...O hydrogen bonds. Furthermore, in the crystal structure of (III), there
    are two molecules in the asymmetric unit, whereas in (I) and (II), only one molecule
    is present.</jats:p>
author:
- first_name: Marie-Luis
  full_name: Schirmer, Marie-Luis
  last_name: Schirmer
- first_name: Anke
  full_name: Spannenberg, Anke
  last_name: Spannenberg
- first_name: Thomas
  full_name: Werner, Thomas
  id: '89271'
  last_name: Werner
  orcid: 0000-0001-9025-3244
citation:
  ama: 'Schirmer M-L, Spannenberg A, Werner T. Highly functionalized alkenes produced
    from base-free organocatalytic Wittig reactions: (<i>E</i>)-3-benzylidenepyrrolidine-2,5-dione,
    (<i>E</i>)-3-benzylidene-1-methylpyrrolidine-2,5-dione and (<i>E</i>)-3-benzylidene-1-<i>tert</i>-butylpyrrolidine-2,5-dione.
    <i>Acta Crystallographica Section C Structural Chemistry</i>. 2016;72(6):504-508.
    doi:<a href="https://doi.org/10.1107/s2053229616008159">10.1107/s2053229616008159</a>'
  apa: 'Schirmer, M.-L., Spannenberg, A., &#38; Werner, T. (2016). Highly functionalized
    alkenes produced from base-free organocatalytic Wittig reactions: (<i>E</i>)-3-benzylidenepyrrolidine-2,5-dione,
    (<i>E</i>)-3-benzylidene-1-methylpyrrolidine-2,5-dione and (<i>E</i>)-3-benzylidene-1-<i>tert</i>-butylpyrrolidine-2,5-dione.
    <i>Acta Crystallographica Section C Structural Chemistry</i>, <i>72</i>(6), 504–508.
    <a href="https://doi.org/10.1107/s2053229616008159">https://doi.org/10.1107/s2053229616008159</a>'
  bibtex: '@article{Schirmer_Spannenberg_Werner_2016, title={Highly functionalized
    alkenes produced from base-free organocatalytic Wittig reactions: (<i>E</i>)-3-benzylidenepyrrolidine-2,5-dione,
    (<i>E</i>)-3-benzylidene-1-methylpyrrolidine-2,5-dione and (<i>E</i>)-3-benzylidene-1-<i>tert</i>-butylpyrrolidine-2,5-dione},
    volume={72}, DOI={<a href="https://doi.org/10.1107/s2053229616008159">10.1107/s2053229616008159</a>},
    number={6}, journal={Acta Crystallographica Section C Structural Chemistry}, publisher={International
    Union of Crystallography (IUCr)}, author={Schirmer, Marie-Luis and Spannenberg,
    Anke and Werner, Thomas}, year={2016}, pages={504–508} }'
  chicago: 'Schirmer, Marie-Luis, Anke Spannenberg, and Thomas Werner. “Highly Functionalized
    Alkenes Produced from Base-Free Organocatalytic Wittig Reactions: (<i>E</i>)-3-Benzylidenepyrrolidine-2,5-Dione,
    (<i>E</i>)-3-Benzylidene-1-Methylpyrrolidine-2,5-Dione and (<i>E</i>)-3-Benzylidene-1-<i>Tert</i>-Butylpyrrolidine-2,5-Dione.”
    <i>Acta Crystallographica Section C Structural Chemistry</i> 72, no. 6 (2016):
    504–8. <a href="https://doi.org/10.1107/s2053229616008159">https://doi.org/10.1107/s2053229616008159</a>.'
  ieee: 'M.-L. Schirmer, A. Spannenberg, and T. Werner, “Highly functionalized alkenes
    produced from base-free organocatalytic Wittig reactions: (<i>E</i>)-3-benzylidenepyrrolidine-2,5-dione,
    (<i>E</i>)-3-benzylidene-1-methylpyrrolidine-2,5-dione and (<i>E</i>)-3-benzylidene-1-<i>tert</i>-butylpyrrolidine-2,5-dione,”
    <i>Acta Crystallographica Section C Structural Chemistry</i>, vol. 72, no. 6,
    pp. 504–508, 2016, doi: <a href="https://doi.org/10.1107/s2053229616008159">10.1107/s2053229616008159</a>.'
  mla: 'Schirmer, Marie-Luis, et al. “Highly Functionalized Alkenes Produced from
    Base-Free Organocatalytic Wittig Reactions: (<i>E</i>)-3-Benzylidenepyrrolidine-2,5-Dione,
    (<i>E</i>)-3-Benzylidene-1-Methylpyrrolidine-2,5-Dione and (<i>E</i>)-3-Benzylidene-1-<i>Tert</i>-Butylpyrrolidine-2,5-Dione.”
    <i>Acta Crystallographica Section C Structural Chemistry</i>, vol. 72, no. 6,
    International Union of Crystallography (IUCr), 2016, pp. 504–08, doi:<a href="https://doi.org/10.1107/s2053229616008159">10.1107/s2053229616008159</a>.'
  short: M.-L. Schirmer, A. Spannenberg, T. Werner, Acta Crystallographica Section
    C Structural Chemistry 72 (2016) 504–508.
date_created: 2023-01-22T21:03:23Z
date_updated: 2025-11-10T09:23:46Z
department:
- _id: '35'
- _id: '2'
- _id: '657'
doi: 10.1107/s2053229616008159
extern: '1'
intvolume: '        72'
issue: '6'
keyword:
- T2
language:
- iso: eng
page: 504-508
publication: Acta Crystallographica Section C Structural Chemistry
publication_identifier:
  issn:
  - 2053-2296
publication_status: published
publisher: International Union of Crystallography (IUCr)
status: public
title: 'Highly functionalized alkenes produced from base-free organocatalytic Wittig
  reactions: (<i>E</i>)-3-benzylidenepyrrolidine-2,5-dione, (<i>E</i>)-3-benzylidene-1-methylpyrrolidine-2,5-dione
  and (<i>E</i>)-3-benzylidene-1-<i>tert</i>-butylpyrrolidine-2,5-dione'
type: journal_article
user_id: '89271'
volume: 72
year: '2016'
...
---
_id: '37981'
abstract:
- lang: eng
  text: <p>The lithium <italic>tert</italic>-butoxide catalyzed addition of CS<sub>2</sub>
    to epoxides and thiiranes under mild conditions is reported. A mechanism has been
    proposed taking into account the regio- and stereochemical outcome of the reaction.</p>
author:
- first_name: J.
  full_name: Diebler, J.
  last_name: Diebler
- first_name: A.
  full_name: Spannenberg, A.
  last_name: Spannenberg
- first_name: Thomas
  full_name: Werner, Thomas
  id: '89271'
  last_name: Werner
  orcid: 0000-0001-9025-3244
citation:
  ama: Diebler J, Spannenberg A, Werner T. Atom economical synthesis of di- and trithiocarbonates
    by the lithium tert-butoxide catalyzed addition of carbon disulfide to epoxides
    and thiiranes. <i>Organic and Biomolecular Chemistry</i>. 2016;14(31):7480-7489.
    doi:<a href="https://doi.org/10.1039/c6ob01081d">10.1039/c6ob01081d</a>
  apa: Diebler, J., Spannenberg, A., &#38; Werner, T. (2016). Atom economical synthesis
    of di- and trithiocarbonates by the lithium tert-butoxide catalyzed addition of
    carbon disulfide to epoxides and thiiranes. <i>Organic and Biomolecular Chemistry</i>,
    <i>14</i>(31), 7480–7489. <a href="https://doi.org/10.1039/c6ob01081d">https://doi.org/10.1039/c6ob01081d</a>
  bibtex: '@article{Diebler_Spannenberg_Werner_2016, title={Atom economical synthesis
    of di- and trithiocarbonates by the lithium tert-butoxide catalyzed addition of
    carbon disulfide to epoxides and thiiranes}, volume={14}, DOI={<a href="https://doi.org/10.1039/c6ob01081d">10.1039/c6ob01081d</a>},
    number={31}, journal={Organic and Biomolecular Chemistry}, publisher={Royal Society
    of Chemistry (RSC)}, author={Diebler, J. and Spannenberg, A. and Werner, Thomas},
    year={2016}, pages={7480–7489} }'
  chicago: 'Diebler, J., A. Spannenberg, and Thomas Werner. “Atom Economical Synthesis
    of Di- and Trithiocarbonates by the Lithium Tert-Butoxide Catalyzed Addition of
    Carbon Disulfide to Epoxides and Thiiranes.” <i>Organic and Biomolecular Chemistry</i>
    14, no. 31 (2016): 7480–89. <a href="https://doi.org/10.1039/c6ob01081d">https://doi.org/10.1039/c6ob01081d</a>.'
  ieee: 'J. Diebler, A. Spannenberg, and T. Werner, “Atom economical synthesis of
    di- and trithiocarbonates by the lithium tert-butoxide catalyzed addition of carbon
    disulfide to epoxides and thiiranes,” <i>Organic and Biomolecular Chemistry</i>,
    vol. 14, no. 31, pp. 7480–7489, 2016, doi: <a href="https://doi.org/10.1039/c6ob01081d">10.1039/c6ob01081d</a>.'
  mla: Diebler, J., et al. “Atom Economical Synthesis of Di- and Trithiocarbonates
    by the Lithium Tert-Butoxide Catalyzed Addition of Carbon Disulfide to Epoxides
    and Thiiranes.” <i>Organic and Biomolecular Chemistry</i>, vol. 14, no. 31, Royal
    Society of Chemistry (RSC), 2016, pp. 7480–89, doi:<a href="https://doi.org/10.1039/c6ob01081d">10.1039/c6ob01081d</a>.
  short: J. Diebler, A. Spannenberg, T. Werner, Organic and Biomolecular Chemistry
    14 (2016) 7480–7489.
date_created: 2023-01-22T21:01:59Z
date_updated: 2025-11-10T09:24:16Z
department:
- _id: '35'
- _id: '2'
- _id: '657'
doi: 10.1039/c6ob01081d
extern: '1'
intvolume: '        14'
issue: '31'
keyword:
- CSSD
language:
- iso: eng
page: 7480-7489
publication: Organic and Biomolecular Chemistry
publication_identifier:
  issn:
  - 1477-0520
  - 1477-0539
publication_status: published
publisher: Royal Society of Chemistry (RSC)
status: public
title: Atom economical synthesis of di- and trithiocarbonates by the lithium tert-butoxide
  catalyzed addition of carbon disulfide to epoxides and thiiranes
type: journal_article
user_id: '89271'
volume: 14
year: '2016'
...
---
_id: '37987'
abstract:
- lang: eng
  text: <p>A novel zinc based binary catalytic system for the synthesis of cyclic
    carbonates under mild and solvent-free conditions utilizing CO<sub>2</sub>as a
    C1 building block is reported.</p>
author:
- first_name: Willi
  full_name: Desens, Willi
  last_name: Desens
- first_name: Christina
  full_name: Kohrt, Christina
  last_name: Kohrt
- first_name: Anke
  full_name: Spannenberg, Anke
  last_name: Spannenberg
- first_name: Thomas
  full_name: Werner, Thomas
  id: '89271'
  last_name: Werner
  orcid: 0000-0001-9025-3244
citation:
  ama: Desens W, Kohrt C, Spannenberg A, Werner T. A novel zinc based binary catalytic
    system for CO<sub>2</sub>utilization under mild conditions. <i>Organic Chemistry
    Frontiers</i>. 2016;3(2):156-164. doi:<a href="https://doi.org/10.1039/c5qo00356c">10.1039/c5qo00356c</a>
  apa: Desens, W., Kohrt, C., Spannenberg, A., &#38; Werner, T. (2016). A novel zinc
    based binary catalytic system for CO<sub>2</sub>utilization under mild conditions.
    <i>Organic Chemistry Frontiers</i>, <i>3</i>(2), 156–164. <a href="https://doi.org/10.1039/c5qo00356c">https://doi.org/10.1039/c5qo00356c</a>
  bibtex: '@article{Desens_Kohrt_Spannenberg_Werner_2016, title={A novel zinc based
    binary catalytic system for CO<sub>2</sub>utilization under mild conditions},
    volume={3}, DOI={<a href="https://doi.org/10.1039/c5qo00356c">10.1039/c5qo00356c</a>},
    number={2}, journal={Organic Chemistry Frontiers}, publisher={Royal Society of
    Chemistry (RSC)}, author={Desens, Willi and Kohrt, Christina and Spannenberg,
    Anke and Werner, Thomas}, year={2016}, pages={156–164} }'
  chicago: 'Desens, Willi, Christina Kohrt, Anke Spannenberg, and Thomas Werner. “A
    Novel Zinc Based Binary Catalytic System for CO<sub>2</sub>Utilization under Mild
    Conditions.” <i>Organic Chemistry Frontiers</i> 3, no. 2 (2016): 156–64. <a href="https://doi.org/10.1039/c5qo00356c">https://doi.org/10.1039/c5qo00356c</a>.'
  ieee: 'W. Desens, C. Kohrt, A. Spannenberg, and T. Werner, “A novel zinc based binary
    catalytic system for CO<sub>2</sub>utilization under mild conditions,” <i>Organic
    Chemistry Frontiers</i>, vol. 3, no. 2, pp. 156–164, 2016, doi: <a href="https://doi.org/10.1039/c5qo00356c">10.1039/c5qo00356c</a>.'
  mla: Desens, Willi, et al. “A Novel Zinc Based Binary Catalytic System for CO<sub>2</sub>Utilization
    under Mild Conditions.” <i>Organic Chemistry Frontiers</i>, vol. 3, no. 2, Royal
    Society of Chemistry (RSC), 2016, pp. 156–64, doi:<a href="https://doi.org/10.1039/c5qo00356c">10.1039/c5qo00356c</a>.
  short: W. Desens, C. Kohrt, A. Spannenberg, T. Werner, Organic Chemistry Frontiers
    3 (2016) 156–164.
date_created: 2023-01-22T21:04:30Z
date_updated: 2025-11-10T09:26:28Z
department:
- _id: '35'
- _id: '2'
- _id: '657'
doi: 10.1039/c5qo00356c
extern: '1'
intvolume: '         3'
issue: '2'
keyword:
- T1
- T3
- CSSD
language:
- iso: eng
page: 156-164
publication: Organic Chemistry Frontiers
publication_identifier:
  issn:
  - 2052-4129
publication_status: published
publisher: Royal Society of Chemistry (RSC)
status: public
title: A novel zinc based binary catalytic system for CO<sub>2</sub>utilization under
  mild conditions
type: journal_article
user_id: '89271'
volume: 3
year: '2016'
...
---
_id: '37982'
author:
- first_name: Johannes
  full_name: Diebler, Johannes
  last_name: Diebler
- first_name: Hartmut
  full_name: Komber, Hartmut
  last_name: Komber
- first_name: Liane
  full_name: Häußler, Liane
  last_name: Häußler
- first_name: Albena
  full_name: Lederer, Albena
  last_name: Lederer
- first_name: Thomas
  full_name: Werner, Thomas
  id: '89271'
  last_name: Werner
  orcid: 0000-0001-9025-3244
citation:
  ama: Diebler J, Komber H, Häußler L, Lederer A, Werner T. Alkoxide-Initiated Regioselective
    Coupling of Carbon Disulfide and Terminal Epoxides for the Synthesis of Strongly
    Alternating Copolymers. <i>Macromolecules</i>. 2016;49(13):4723-4731. doi:<a href="https://doi.org/10.1021/acs.macromol.6b00728">10.1021/acs.macromol.6b00728</a>
  apa: Diebler, J., Komber, H., Häußler, L., Lederer, A., &#38; Werner, T. (2016).
    Alkoxide-Initiated Regioselective Coupling of Carbon Disulfide and Terminal Epoxides
    for the Synthesis of Strongly Alternating Copolymers. <i>Macromolecules</i>, <i>49</i>(13),
    4723–4731. <a href="https://doi.org/10.1021/acs.macromol.6b00728">https://doi.org/10.1021/acs.macromol.6b00728</a>
  bibtex: '@article{Diebler_Komber_Häußler_Lederer_Werner_2016, title={Alkoxide-Initiated
    Regioselective Coupling of Carbon Disulfide and Terminal Epoxides for the Synthesis
    of Strongly Alternating Copolymers}, volume={49}, DOI={<a href="https://doi.org/10.1021/acs.macromol.6b00728">10.1021/acs.macromol.6b00728</a>},
    number={13}, journal={Macromolecules}, publisher={American Chemical Society (ACS)},
    author={Diebler, Johannes and Komber, Hartmut and Häußler, Liane and Lederer,
    Albena and Werner, Thomas}, year={2016}, pages={4723–4731} }'
  chicago: 'Diebler, Johannes, Hartmut Komber, Liane Häußler, Albena Lederer, and
    Thomas Werner. “Alkoxide-Initiated Regioselective Coupling of Carbon Disulfide
    and Terminal Epoxides for the Synthesis of Strongly Alternating Copolymers.” <i>Macromolecules</i>
    49, no. 13 (2016): 4723–31. <a href="https://doi.org/10.1021/acs.macromol.6b00728">https://doi.org/10.1021/acs.macromol.6b00728</a>.'
  ieee: 'J. Diebler, H. Komber, L. Häußler, A. Lederer, and T. Werner, “Alkoxide-Initiated
    Regioselective Coupling of Carbon Disulfide and Terminal Epoxides for the Synthesis
    of Strongly Alternating Copolymers,” <i>Macromolecules</i>, vol. 49, no. 13, pp.
    4723–4731, 2016, doi: <a href="https://doi.org/10.1021/acs.macromol.6b00728">10.1021/acs.macromol.6b00728</a>.'
  mla: Diebler, Johannes, et al. “Alkoxide-Initiated Regioselective Coupling of Carbon
    Disulfide and Terminal Epoxides for the Synthesis of Strongly Alternating Copolymers.”
    <i>Macromolecules</i>, vol. 49, no. 13, American Chemical Society (ACS), 2016,
    pp. 4723–31, doi:<a href="https://doi.org/10.1021/acs.macromol.6b00728">10.1021/acs.macromol.6b00728</a>.
  short: J. Diebler, H. Komber, L. Häußler, A. Lederer, T. Werner, Macromolecules
    49 (2016) 4723–4731.
date_created: 2023-01-22T21:02:41Z
date_updated: 2025-11-10T09:25:16Z
department:
- _id: '35'
- _id: '2'
- _id: '657'
doi: 10.1021/acs.macromol.6b00728
extern: '1'
intvolume: '        49'
issue: '13'
keyword:
- CSSD
language:
- iso: eng
page: 4723-4731
publication: Macromolecules
publication_identifier:
  issn:
  - 0024-9297
  - 1520-5835
publication_status: published
publisher: American Chemical Society (ACS)
status: public
title: Alkoxide-Initiated Regioselective Coupling of Carbon Disulfide and Terminal
  Epoxides for the Synthesis of Strongly Alternating Copolymers
type: journal_article
user_id: '89271'
volume: 49
year: '2016'
...
---
_id: '37980'
author:
- first_name: Hendrik
  full_name: Büttner, Hendrik
  last_name: Büttner
- first_name: Christoph
  full_name: Grimmer, Christoph
  last_name: Grimmer
- first_name: Johannes
  full_name: Steinbauer, Johannes
  last_name: Steinbauer
- first_name: Thomas
  full_name: Werner, Thomas
  id: '89271'
  last_name: Werner
  orcid: 0000-0001-9025-3244
citation:
  ama: Büttner H, Grimmer C, Steinbauer J, Werner T. Iron-Based Binary Catalytic System
    for the Valorization of CO<sub>2</sub> into Biobased Cyclic Carbonates. <i>ACS
    Sustainable Chemistry &#38;amp; Engineering</i>. 2016;4(9):4805-4814. doi:<a href="https://doi.org/10.1021/acssuschemeng.6b01092">10.1021/acssuschemeng.6b01092</a>
  apa: Büttner, H., Grimmer, C., Steinbauer, J., &#38; Werner, T. (2016). Iron-Based
    Binary Catalytic System for the Valorization of CO<sub>2</sub> into Biobased Cyclic
    Carbonates. <i>ACS Sustainable Chemistry &#38;amp; Engineering</i>, <i>4</i>(9),
    4805–4814. <a href="https://doi.org/10.1021/acssuschemeng.6b01092">https://doi.org/10.1021/acssuschemeng.6b01092</a>
  bibtex: '@article{Büttner_Grimmer_Steinbauer_Werner_2016, title={Iron-Based Binary
    Catalytic System for the Valorization of CO<sub>2</sub> into Biobased Cyclic Carbonates},
    volume={4}, DOI={<a href="https://doi.org/10.1021/acssuschemeng.6b01092">10.1021/acssuschemeng.6b01092</a>},
    number={9}, journal={ACS Sustainable Chemistry &#38;amp; Engineering}, publisher={American
    Chemical Society (ACS)}, author={Büttner, Hendrik and Grimmer, Christoph and Steinbauer,
    Johannes and Werner, Thomas}, year={2016}, pages={4805–4814} }'
  chicago: 'Büttner, Hendrik, Christoph Grimmer, Johannes Steinbauer, and Thomas Werner.
    “Iron-Based Binary Catalytic System for the Valorization of CO<sub>2</sub> into
    Biobased Cyclic Carbonates.” <i>ACS Sustainable Chemistry &#38;amp; Engineering</i>
    4, no. 9 (2016): 4805–14. <a href="https://doi.org/10.1021/acssuschemeng.6b01092">https://doi.org/10.1021/acssuschemeng.6b01092</a>.'
  ieee: 'H. Büttner, C. Grimmer, J. Steinbauer, and T. Werner, “Iron-Based Binary
    Catalytic System for the Valorization of CO<sub>2</sub> into Biobased Cyclic Carbonates,”
    <i>ACS Sustainable Chemistry &#38;amp; Engineering</i>, vol. 4, no. 9, pp. 4805–4814,
    2016, doi: <a href="https://doi.org/10.1021/acssuschemeng.6b01092">10.1021/acssuschemeng.6b01092</a>.'
  mla: Büttner, Hendrik, et al. “Iron-Based Binary Catalytic System for the Valorization
    of CO<sub>2</sub> into Biobased Cyclic Carbonates.” <i>ACS Sustainable Chemistry
    &#38;amp; Engineering</i>, vol. 4, no. 9, American Chemical Society (ACS), 2016,
    pp. 4805–14, doi:<a href="https://doi.org/10.1021/acssuschemeng.6b01092">10.1021/acssuschemeng.6b01092</a>.
  short: H. Büttner, C. Grimmer, J. Steinbauer, T. Werner, ACS Sustainable Chemistry
    &#38;amp; Engineering 4 (2016) 4805–4814.
date_created: 2023-01-22T21:01:04Z
date_updated: 2025-11-10T09:26:56Z
department:
- _id: '35'
- _id: '2'
- _id: '657'
doi: 10.1021/acssuschemeng.6b01092
extern: '1'
intvolume: '         4'
issue: '9'
keyword:
- T1
- T3
- CSSD
language:
- iso: eng
page: 4805-4814
publication: ACS Sustainable Chemistry &amp; Engineering
publication_identifier:
  issn:
  - 2168-0485
  - 2168-0485
publication_status: published
publisher: American Chemical Society (ACS)
status: public
title: Iron-Based Binary Catalytic System for the Valorization of CO<sub>2</sub> into
  Biobased Cyclic Carbonates
type: journal_article
user_id: '89271'
volume: 4
year: '2016'
...
---
_id: '37986'
author:
- first_name: Marie-Luis
  full_name: Schirmer, Marie-Luis
  last_name: Schirmer
- first_name: Sven
  full_name: Adomeit, Sven
  last_name: Adomeit
- first_name: Anke
  full_name: Spannenberg, Anke
  last_name: Spannenberg
- first_name: Thomas
  full_name: Werner, Thomas
  id: '89271'
  last_name: Werner
  orcid: 0000-0001-9025-3244
citation:
  ama: Schirmer M-L, Adomeit S, Spannenberg A, Werner T. Novel Base-Free Catalytic
    Wittig Reaction for the Synthesis of Highly Functionalized Alkenes. <i>Chemistry
    - A European Journal</i>. 2016;22(7):2458-2465. doi:<a href="https://doi.org/10.1002/chem.201503744">10.1002/chem.201503744</a>
  apa: Schirmer, M.-L., Adomeit, S., Spannenberg, A., &#38; Werner, T. (2016). Novel
    Base-Free Catalytic Wittig Reaction for the Synthesis of Highly Functionalized
    Alkenes. <i>Chemistry - A European Journal</i>, <i>22</i>(7), 2458–2465. <a href="https://doi.org/10.1002/chem.201503744">https://doi.org/10.1002/chem.201503744</a>
  bibtex: '@article{Schirmer_Adomeit_Spannenberg_Werner_2016, title={Novel Base-Free
    Catalytic Wittig Reaction for the Synthesis of Highly Functionalized Alkenes},
    volume={22}, DOI={<a href="https://doi.org/10.1002/chem.201503744">10.1002/chem.201503744</a>},
    number={7}, journal={Chemistry - A European Journal}, publisher={Wiley}, author={Schirmer,
    Marie-Luis and Adomeit, Sven and Spannenberg, Anke and Werner, Thomas}, year={2016},
    pages={2458–2465} }'
  chicago: 'Schirmer, Marie-Luis, Sven Adomeit, Anke Spannenberg, and Thomas Werner.
    “Novel Base-Free Catalytic Wittig Reaction for the Synthesis of Highly Functionalized
    Alkenes.” <i>Chemistry - A European Journal</i> 22, no. 7 (2016): 2458–65. <a
    href="https://doi.org/10.1002/chem.201503744">https://doi.org/10.1002/chem.201503744</a>.'
  ieee: 'M.-L. Schirmer, S. Adomeit, A. Spannenberg, and T. Werner, “Novel Base-Free
    Catalytic Wittig Reaction for the Synthesis of Highly Functionalized Alkenes,”
    <i>Chemistry - A European Journal</i>, vol. 22, no. 7, pp. 2458–2465, 2016, doi:
    <a href="https://doi.org/10.1002/chem.201503744">10.1002/chem.201503744</a>.'
  mla: Schirmer, Marie-Luis, et al. “Novel Base-Free Catalytic Wittig Reaction for
    the Synthesis of Highly Functionalized Alkenes.” <i>Chemistry - A European Journal</i>,
    vol. 22, no. 7, Wiley, 2016, pp. 2458–65, doi:<a href="https://doi.org/10.1002/chem.201503744">10.1002/chem.201503744</a>.
  short: M.-L. Schirmer, S. Adomeit, A. Spannenberg, T. Werner, Chemistry - A European
    Journal 22 (2016) 2458–2465.
date_created: 2023-01-22T21:04:06Z
date_updated: 2025-11-10T09:23:00Z
department:
- _id: '35'
- _id: '2'
- _id: '657'
doi: 10.1002/chem.201503744
extern: '1'
intvolume: '        22'
issue: '7'
keyword:
- T2
- CSSD
language:
- iso: eng
page: 2458-2465
publication: Chemistry - A European Journal
publication_identifier:
  issn:
  - 0947-6539
publication_status: published
publisher: Wiley
status: public
title: Novel Base-Free Catalytic Wittig Reaction for the Synthesis of Highly Functionalized
  Alkenes
type: journal_article
user_id: '89271'
volume: 22
year: '2016'
...
---
_id: '37985'
author:
- first_name: Johannes
  full_name: Diebler, Johannes
  last_name: Diebler
- first_name: Anke
  full_name: Spannenberg, Anke
  last_name: Spannenberg
- first_name: Thomas
  full_name: Werner, Thomas
  id: '89271'
  last_name: Werner
  orcid: 0000-0001-9025-3244
citation:
  ama: Diebler J, Spannenberg A, Werner T. Regio- and Stereoselective Synthesis of
    Dithiocarbonates under Ambient and Solvent-Free Conditions. <i>ChemCatChem</i>.
    2016;8(12):2027-2030. doi:<a href="https://doi.org/10.1002/cctc.201600242">10.1002/cctc.201600242</a>
  apa: Diebler, J., Spannenberg, A., &#38; Werner, T. (2016). Regio- and Stereoselective
    Synthesis of Dithiocarbonates under Ambient and Solvent-Free Conditions. <i>ChemCatChem</i>,
    <i>8</i>(12), 2027–2030. <a href="https://doi.org/10.1002/cctc.201600242">https://doi.org/10.1002/cctc.201600242</a>
  bibtex: '@article{Diebler_Spannenberg_Werner_2016, title={Regio- and Stereoselective
    Synthesis of Dithiocarbonates under Ambient and Solvent-Free Conditions}, volume={8},
    DOI={<a href="https://doi.org/10.1002/cctc.201600242">10.1002/cctc.201600242</a>},
    number={12}, journal={ChemCatChem}, publisher={Wiley}, author={Diebler, Johannes
    and Spannenberg, Anke and Werner, Thomas}, year={2016}, pages={2027–2030} }'
  chicago: 'Diebler, Johannes, Anke Spannenberg, and Thomas Werner. “Regio- and Stereoselective
    Synthesis of Dithiocarbonates under Ambient and Solvent-Free Conditions.” <i>ChemCatChem</i>
    8, no. 12 (2016): 2027–30. <a href="https://doi.org/10.1002/cctc.201600242">https://doi.org/10.1002/cctc.201600242</a>.'
  ieee: 'J. Diebler, A. Spannenberg, and T. Werner, “Regio- and Stereoselective Synthesis
    of Dithiocarbonates under Ambient and Solvent-Free Conditions,” <i>ChemCatChem</i>,
    vol. 8, no. 12, pp. 2027–2030, 2016, doi: <a href="https://doi.org/10.1002/cctc.201600242">10.1002/cctc.201600242</a>.'
  mla: Diebler, Johannes, et al. “Regio- and Stereoselective Synthesis of Dithiocarbonates
    under Ambient and Solvent-Free Conditions.” <i>ChemCatChem</i>, vol. 8, no. 12,
    Wiley, 2016, pp. 2027–30, doi:<a href="https://doi.org/10.1002/cctc.201600242">10.1002/cctc.201600242</a>.
  short: J. Diebler, A. Spannenberg, T. Werner, ChemCatChem 8 (2016) 2027–2030.
date_created: 2023-01-22T21:03:46Z
date_updated: 2025-11-10T09:24:45Z
department:
- _id: '35'
- _id: '2'
- _id: '657'
doi: 10.1002/cctc.201600242
extern: '1'
intvolume: '         8'
issue: '12'
keyword:
- CSSD
language:
- iso: eng
page: 2027-2030
publication: ChemCatChem
publication_identifier:
  issn:
  - 1867-3880
publication_status: published
publisher: Wiley
status: public
title: Regio- and Stereoselective Synthesis of Dithiocarbonates under Ambient and
  Solvent-Free Conditions
type: journal_article
user_id: '89271'
volume: 8
year: '2016'
...
---
_id: '37988'
author:
- first_name: Willi
  full_name: Desens, Willi
  last_name: Desens
- first_name: Thomas
  full_name: Werner, Thomas
  id: '89271'
  last_name: Werner
  orcid: 0000-0001-9025-3244
citation:
  ama: Desens W, Werner T. Convergent Activation Concept for CO<sub>2</sub>Fixation
    in Carbonates. <i>Advanced Synthesis and Catalysis</i>. 2016;358(4):622-630. doi:<a
    href="https://doi.org/10.1002/adsc.201500941">10.1002/adsc.201500941</a>
  apa: Desens, W., &#38; Werner, T. (2016). Convergent Activation Concept for CO<sub>2</sub>Fixation
    in Carbonates. <i>Advanced Synthesis and Catalysis</i>, <i>358</i>(4), 622–630.
    <a href="https://doi.org/10.1002/adsc.201500941">https://doi.org/10.1002/adsc.201500941</a>
  bibtex: '@article{Desens_Werner_2016, title={Convergent Activation Concept for CO<sub>2</sub>Fixation
    in Carbonates}, volume={358}, DOI={<a href="https://doi.org/10.1002/adsc.201500941">10.1002/adsc.201500941</a>},
    number={4}, journal={Advanced Synthesis and Catalysis}, publisher={Wiley}, author={Desens,
    Willi and Werner, Thomas}, year={2016}, pages={622–630} }'
  chicago: 'Desens, Willi, and Thomas Werner. “Convergent Activation Concept for CO<sub>2</sub>Fixation
    in Carbonates.” <i>Advanced Synthesis and Catalysis</i> 358, no. 4 (2016): 622–30.
    <a href="https://doi.org/10.1002/adsc.201500941">https://doi.org/10.1002/adsc.201500941</a>.'
  ieee: 'W. Desens and T. Werner, “Convergent Activation Concept for CO<sub>2</sub>Fixation
    in Carbonates,” <i>Advanced Synthesis and Catalysis</i>, vol. 358, no. 4, pp.
    622–630, 2016, doi: <a href="https://doi.org/10.1002/adsc.201500941">10.1002/adsc.201500941</a>.'
  mla: Desens, Willi, and Thomas Werner. “Convergent Activation Concept for CO<sub>2</sub>Fixation
    in Carbonates.” <i>Advanced Synthesis and Catalysis</i>, vol. 358, no. 4, Wiley,
    2016, pp. 622–30, doi:<a href="https://doi.org/10.1002/adsc.201500941">10.1002/adsc.201500941</a>.
  short: W. Desens, T. Werner, Advanced Synthesis and Catalysis 358 (2016) 622–630.
date_created: 2023-01-22T21:04:52Z
date_updated: 2025-11-10T09:25:53Z
department:
- _id: '35'
- _id: '2'
- _id: '657'
doi: 10.1002/adsc.201500941
extern: '1'
intvolume: '       358'
issue: '4'
keyword:
- T1
- CSSD
language:
- iso: eng
page: 622-630
publication: Advanced Synthesis and Catalysis
publication_identifier:
  issn:
  - 1615-4150
publication_status: published
publisher: Wiley
status: public
title: Convergent Activation Concept for CO<sub>2</sub>Fixation in Carbonates
type: journal_article
user_id: '89271'
volume: 358
year: '2016'
...
---
_id: '62782'
abstract:
- lang: eng
  text: <jats:title>Abstract</jats:title><jats:p>A finite strain micro‐sphere framework
    for hyperelastic solids elaborated by Carol et al. is extended towards the modelling
    of phase transformations in order to simulate polycrystalline solids under large
    deformations such as, e.g., shape memory alloys and shape memory polymers. The
    implemented phase transformation mechanism is based on statistical physics and
    is not restricted in terms of the number of solid material phases that can be
    considered, though we restrict the provided examples to two phases for the sake
    of conceptual clarity. The specifically chosen non‐quadratic format of the Helmholtz
    free energy functions considered on the micro‐plane level includes Bain‐type transformation
    strains for each of the phases considered. Following the Voigt assumption on the
    micro‐scale, identical total micro‐stretches act in each of the material phases,
    where a multiplicative decomposition into elastic and transformation‐related contributions
    is applied. (© 2016 Wiley‐VCH Verlag GmbH &amp; Co. KGaA, Weinheim)</jats:p>
author:
- first_name: Richard
  full_name: Ostwald, Richard
  id: '106876'
  last_name: Ostwald
  orcid: 0000-0003-2147-8444
- first_name: Thorsten
  full_name: Bartel, Thorsten
  last_name: Bartel
- first_name: Andreas
  full_name: Menzel, Andreas
  last_name: Menzel
citation:
  ama: Ostwald R, Bartel T, Menzel A. Extending a finite strain hyperelastic micro‐sphere
    framework towards phase transformations. <i>PAMM</i>. 2016;16(1):381-382. doi:<a
    href="https://doi.org/10.1002/pamm.201610179">10.1002/pamm.201610179</a>
  apa: Ostwald, R., Bartel, T., &#38; Menzel, A. (2016). Extending a finite strain
    hyperelastic micro‐sphere framework towards phase transformations. <i>PAMM</i>,
    <i>16</i>(1), 381–382. <a href="https://doi.org/10.1002/pamm.201610179">https://doi.org/10.1002/pamm.201610179</a>
  bibtex: '@article{Ostwald_Bartel_Menzel_2016, title={Extending a finite strain hyperelastic
    micro‐sphere framework towards phase transformations}, volume={16}, DOI={<a href="https://doi.org/10.1002/pamm.201610179">10.1002/pamm.201610179</a>},
    number={1}, journal={PAMM}, publisher={Wiley}, author={Ostwald, Richard and Bartel,
    Thorsten and Menzel, Andreas}, year={2016}, pages={381–382} }'
  chicago: 'Ostwald, Richard, Thorsten Bartel, and Andreas Menzel. “Extending a Finite
    Strain Hyperelastic Micro‐sphere Framework towards Phase Transformations.” <i>PAMM</i>
    16, no. 1 (2016): 381–82. <a href="https://doi.org/10.1002/pamm.201610179">https://doi.org/10.1002/pamm.201610179</a>.'
  ieee: 'R. Ostwald, T. Bartel, and A. Menzel, “Extending a finite strain hyperelastic
    micro‐sphere framework towards phase transformations,” <i>PAMM</i>, vol. 16, no.
    1, pp. 381–382, 2016, doi: <a href="https://doi.org/10.1002/pamm.201610179">10.1002/pamm.201610179</a>.'
  mla: Ostwald, Richard, et al. “Extending a Finite Strain Hyperelastic Micro‐sphere
    Framework towards Phase Transformations.” <i>PAMM</i>, vol. 16, no. 1, Wiley,
    2016, pp. 381–82, doi:<a href="https://doi.org/10.1002/pamm.201610179">10.1002/pamm.201610179</a>.
  short: R. Ostwald, T. Bartel, A. Menzel, PAMM 16 (2016) 381–382.
date_created: 2025-12-03T13:09:18Z
date_updated: 2025-12-03T13:10:01Z
department:
- _id: '952'
- _id: '321'
doi: 10.1002/pamm.201610179
intvolume: '        16'
issue: '1'
language:
- iso: eng
page: 381-382
publication: PAMM
publication_identifier:
  issn:
  - 1617-7061
  - 1617-7061
publication_status: published
publisher: Wiley
quality_controlled: '1'
status: public
title: Extending a finite strain hyperelastic micro‐sphere framework towards phase
  transformations
type: journal_article
user_id: '85414'
volume: 16
year: '2016'
...
---
_id: '62857'
abstract:
- lang: eng
  text: 'The recovery of rare earth metals from secondary sources has attracted much
    attention due to their ever expanding demand in the high-tech industry. The studies
    reported here focus on the hydrometallurgical recovery of lanthanum and cerium
    from spent fluid catalytic cracking (FCC) catalysts in a two-step process: leaching
    with nitric acid and solvent extraction by tri-n-butyl phosphate (TBP) and di(2-ethylhexyl)phosphoric
    acid (D2EHPA). The experiments show a high dissolution yield of about 93% lanthanum
    and 42% cerium in a single leaching step with 2 M (126 g/L) HNO3 at 80 °C; only
    11% aluminum has been dissolved simultaneously. In the subsequent solvent extraction
    step the best results for this leach liquor could be achieved using a 1:1 mixture
    of 25% (v/v) TBP (0.92 M) and 25% (v/v) D2EHPA (0.76 M) in n-decane without the
    need for any pH adjustment. In that case La(III) and Ce(III) can be extracted
    with 60% and 74% yield respectively in one stage from the majority of accompanying
    matrix elements. In particular no extraction of Al(III) could be observed under
    these conditions.'
author:
- first_name: M.
  full_name: Wenzel, M.
  last_name: Wenzel
- first_name: Kathleen
  full_name: Schnaars, Kathleen
  id: '117735'
  last_name: Schnaars
- first_name: N.
  full_name: Kelly, N.
  last_name: Kelly
- first_name: L.
  full_name: Götzke, L.
  last_name: Götzke
- first_name: S. M.
  full_name: Robles, S. M.
  last_name: Robles
- first_name: K.
  full_name: Kretschmer, K.
  last_name: Kretschmer
- first_name: Phuc Nguyen
  full_name: Le, Phuc Nguyen
  last_name: Le
- first_name: Dang Thanh
  full_name: Tung, Dang Thanh
  last_name: Tung
- first_name: Nguyen Huu
  full_name: Luong, Nguyen Huu
  last_name: Luong
- first_name: Nguyen Anh
  full_name: Duc, Nguyen Anh
  last_name: Duc
- first_name: Dang Van
  full_name: Sy, Dang Van
  last_name: Sy
- first_name: K.
  full_name: Gloe, K.
  last_name: Gloe
- first_name: J. J.
  full_name: Weigand, J. J.
  last_name: Weigand
citation:
  ama: 'Wenzel M, Schnaars K, Kelly N, et al. Hydrometallurgical Recovery of Rare
    Earth Metals from Spent FCC Catalysts. In: <i>Rare Metal Technology 2016</i>.
    Springer International Publishing; 2016. doi:<a href="https://doi.org/10.1007/978-3-319-48135-7_4">10.1007/978-3-319-48135-7_4</a>'
  apa: Wenzel, M., Schnaars, K., Kelly, N., Götzke, L., Robles, S. M., Kretschmer,
    K., Le, P. N., Tung, D. T., Luong, N. H., Duc, N. A., Sy, D. V., Gloe, K., &#38;
    Weigand, J. J. (2016). Hydrometallurgical Recovery of Rare Earth Metals from Spent
    FCC Catalysts. In <i>Rare Metal Technology 2016</i>. Springer International Publishing.
    <a href="https://doi.org/10.1007/978-3-319-48135-7_4">https://doi.org/10.1007/978-3-319-48135-7_4</a>
  bibtex: '@inbook{Wenzel_Schnaars_Kelly_Götzke_Robles_Kretschmer_Le_Tung_Luong_Duc_et
    al._2016, place={Cham}, title={Hydrometallurgical Recovery of Rare Earth Metals
    from Spent FCC Catalysts}, DOI={<a href="https://doi.org/10.1007/978-3-319-48135-7_4">10.1007/978-3-319-48135-7_4</a>},
    booktitle={Rare Metal Technology 2016}, publisher={Springer International Publishing},
    author={Wenzel, M. and Schnaars, Kathleen and Kelly, N. and Götzke, L. and Robles,
    S. M. and Kretschmer, K. and Le, Phuc Nguyen and Tung, Dang Thanh and Luong, Nguyen
    Huu and Duc, Nguyen Anh and et al.}, year={2016} }'
  chicago: 'Wenzel, M., Kathleen Schnaars, N. Kelly, L. Götzke, S. M. Robles, K. Kretschmer,
    Phuc Nguyen Le, et al. “Hydrometallurgical Recovery of Rare Earth Metals from
    Spent FCC Catalysts.” In <i>Rare Metal Technology 2016</i>. Cham: Springer International
    Publishing, 2016. <a href="https://doi.org/10.1007/978-3-319-48135-7_4">https://doi.org/10.1007/978-3-319-48135-7_4</a>.'
  ieee: 'M. Wenzel <i>et al.</i>, “Hydrometallurgical Recovery of Rare Earth Metals
    from Spent FCC Catalysts,” in <i>Rare Metal Technology 2016</i>, Cham: Springer
    International Publishing, 2016.'
  mla: Wenzel, M., et al. “Hydrometallurgical Recovery of Rare Earth Metals from Spent
    FCC Catalysts.” <i>Rare Metal Technology 2016</i>, Springer International Publishing,
    2016, doi:<a href="https://doi.org/10.1007/978-3-319-48135-7_4">10.1007/978-3-319-48135-7_4</a>.
  short: 'M. Wenzel, K. Schnaars, N. Kelly, L. Götzke, S.M. Robles, K. Kretschmer,
    P.N. Le, D.T. Tung, N.H. Luong, N.A. Duc, D.V. Sy, K. Gloe, J.J. Weigand, in:
    Rare Metal Technology 2016, Springer International Publishing, Cham, 2016.'
date_created: 2025-12-04T12:15:35Z
date_updated: 2025-12-04T12:19:23Z
department:
- _id: '985'
doi: 10.1007/978-3-319-48135-7_4
extern: '1'
language:
- iso: eng
place: Cham
publication: Rare Metal Technology 2016
publication_identifier:
  isbn:
  - '9783319486161'
  - '9783319481357'
publication_status: published
publisher: Springer International Publishing
quality_controlled: '1'
status: public
title: Hydrometallurgical Recovery of Rare Earth Metals from Spent FCC Catalysts
type: book_chapter
user_id: '117735'
year: '2016'
...
---
_id: '10024'
abstract:
- lang: eng
  text: The influence of electronic many-body interactions, spin-orbit coupling, and
    thermal lattice vibrations on the electronic structure of lithium niobate is calculated
    from first principles. Self-energy calculations in the GW approximation show that
    the inclusion of self-consistency in the Green function G and the screened Coulomb
    potential W opens the band gap far stronger than found in previous G0W0 calculations
    but slightly overestimates its actual value due to the neglect of excitonic effects
    in W. A realistic frozen-lattice band gap of about 5.9 eV is obtained by combining
    hybrid density functional theory with the QSGW0 scheme. The renormalization of
    the band gap due to electron-phonon coupling, derived here using molecular dynamics
    as well as density functional perturbation theory, reduces this value by about
    0.5 eV at room temperature. Spin-orbit coupling does not noticeably modify the
    fundamental gap but gives rise to a Rashba-like spin texture in the conduction
    band.
article_number: '075205'
article_type: original
author:
- first_name: Arthur
  full_name: Riefer, Arthur
  last_name: Riefer
- first_name: Michael
  full_name: Friedrich, Michael
  last_name: Friedrich
- first_name: Simone
  full_name: Sanna, Simone
  last_name: Sanna
- first_name: Uwe
  full_name: Gerstmann, Uwe
  id: '171'
  last_name: Gerstmann
  orcid: 0000-0002-4476-223X
- first_name: Arno
  full_name: Schindlmayr, Arno
  id: '458'
  last_name: Schindlmayr
  orcid: 0000-0002-4855-071X
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: 'Riefer A, Friedrich M, Sanna S, Gerstmann U, Schindlmayr A, Schmidt WG. LiNbO3
    electronic structure: Many-body interactions, spin-orbit coupling, and thermal
    effects. <i>Physical Review B</i>. 2016;93(7). doi:<a href="https://doi.org/10.1103/PhysRevB.93.075205">10.1103/PhysRevB.93.075205</a>'
  apa: 'Riefer, A., Friedrich, M., Sanna, S., Gerstmann, U., Schindlmayr, A., &#38;
    Schmidt, W. G. (2016). LiNbO3 electronic structure: Many-body interactions, spin-orbit
    coupling, and thermal effects. <i>Physical Review B</i>, <i>93</i>(7), Article
    075205. <a href="https://doi.org/10.1103/PhysRevB.93.075205">https://doi.org/10.1103/PhysRevB.93.075205</a>'
  bibtex: '@article{Riefer_Friedrich_Sanna_Gerstmann_Schindlmayr_Schmidt_2016, title={LiNbO3
    electronic structure: Many-body interactions, spin-orbit coupling, and thermal
    effects}, volume={93}, DOI={<a href="https://doi.org/10.1103/PhysRevB.93.075205">10.1103/PhysRevB.93.075205</a>},
    number={7075205}, journal={Physical Review B}, publisher={American Physical Society},
    author={Riefer, Arthur and Friedrich, Michael and Sanna, Simone and Gerstmann,
    Uwe and Schindlmayr, Arno and Schmidt, Wolf Gero}, year={2016} }'
  chicago: 'Riefer, Arthur, Michael Friedrich, Simone Sanna, Uwe Gerstmann, Arno Schindlmayr,
    and Wolf Gero Schmidt. “LiNbO3 Electronic Structure: Many-Body Interactions, Spin-Orbit
    Coupling, and Thermal Effects.” <i>Physical Review B</i> 93, no. 7 (2016). <a
    href="https://doi.org/10.1103/PhysRevB.93.075205">https://doi.org/10.1103/PhysRevB.93.075205</a>.'
  ieee: 'A. Riefer, M. Friedrich, S. Sanna, U. Gerstmann, A. Schindlmayr, and W. G.
    Schmidt, “LiNbO3 electronic structure: Many-body interactions, spin-orbit coupling,
    and thermal effects,” <i>Physical Review B</i>, vol. 93, no. 7, Art. no. 075205,
    2016, doi: <a href="https://doi.org/10.1103/PhysRevB.93.075205">10.1103/PhysRevB.93.075205</a>.'
  mla: 'Riefer, Arthur, et al. “LiNbO3 Electronic Structure: Many-Body Interactions,
    Spin-Orbit Coupling, and Thermal Effects.” <i>Physical Review B</i>, vol. 93,
    no. 7, 075205, American Physical Society, 2016, doi:<a href="https://doi.org/10.1103/PhysRevB.93.075205">10.1103/PhysRevB.93.075205</a>.'
  short: A. Riefer, M. Friedrich, S. Sanna, U. Gerstmann, A. Schindlmayr, W.G. Schmidt,
    Physical Review B 93 (2016).
date_created: 2019-05-29T07:50:59Z
date_updated: 2025-12-05T09:59:57Z
ddc:
- '530'
department:
- _id: '295'
- _id: '296'
- _id: '230'
- _id: '429'
- _id: '790'
- _id: '15'
- _id: '35'
- _id: '27'
doi: 10.1103/PhysRevB.93.075205
external_id:
  isi:
  - '000370794800004'
file:
- access_level: open_access
  content_type: application/pdf
  creator: schindlm
  date_created: 2020-08-27T20:36:43Z
  date_updated: 2020-08-30T14:39:23Z
  description: © 2016 American Physical Society
  file_id: '18469'
  file_name: PhysRevB.93.075205.pdf
  file_size: 1314637
  relation: main_file
  title: 'LiNbO3 electronic structure: Many-body interactions, spin-orbit coupling,
    and thermal effects'
file_date_updated: 2020-08-30T14:39:23Z
has_accepted_license: '1'
intvolume: '        93'
isi: '1'
issue: '7'
language:
- iso: eng
oa: '1'
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
- _id: '53'
  name: TRR 142
- _id: '55'
  name: TRR 142 - Project Area B
- _id: '69'
  name: TRR 142 - Subproject B4
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Physical Review B
publication_identifier:
  eissn:
  - 2469-9969
  issn:
  - 2469-9950
publication_status: published
publisher: American Physical Society
quality_controlled: '1'
status: public
title: 'LiNbO3 electronic structure: Many-body interactions, spin-orbit coupling,
  and thermal effects'
type: journal_article
user_id: '16199'
volume: 93
year: '2016'
...
---
_id: '10025'
abstract:
- lang: eng
  text: The phonon dispersions of the ferro‐ and paraelectric phase of LiTaO3 are
    calculated within density‐functional perturbation theory. The longitudinal optical
    phonon modes are theoretically derived and compared with available experimental
    data. Our results confirm the recent phonon assignment proposed by Margueron et
    al. [J. Appl. Phys. 111, 104105 (2012)] on the basis of spectroscopical studies.
    A comparison with the phonon band structure of the related material LiNbO3 shows
    minor differences that can be traced to the atomic‐mass difference between Ta
    and Nb. The presence of phonons with imaginary frequencies for the paraelectric
    phase suggests that it does not correspond to a minimum energy structure, and
    is compatible with an order‐disorder type phase transition.
article_type: original
author:
- first_name: Michael
  full_name: Friedrich, Michael
  last_name: Friedrich
- first_name: Arno
  full_name: Schindlmayr, Arno
  id: '458'
  last_name: Schindlmayr
  orcid: 0000-0002-4855-071X
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: Simone
  full_name: Sanna, Simone
  last_name: Sanna
citation:
  ama: Friedrich M, Schindlmayr A, Schmidt WG, Sanna S. LiTaO3 phonon dispersion and
    ferroelectric transition calculated from first principles. <i>Physica Status Solidi
    B</i>. 2016;253(4):683-689. doi:<a href="https://doi.org/10.1002/pssb.201552576">10.1002/pssb.201552576</a>
  apa: Friedrich, M., Schindlmayr, A., Schmidt, W. G., &#38; Sanna, S. (2016). LiTaO3
    phonon dispersion and ferroelectric transition calculated from first principles.
    <i>Physica Status Solidi B</i>, <i>253</i>(4), 683–689. <a href="https://doi.org/10.1002/pssb.201552576">https://doi.org/10.1002/pssb.201552576</a>
  bibtex: '@article{Friedrich_Schindlmayr_Schmidt_Sanna_2016, title={LiTaO3 phonon
    dispersion and ferroelectric transition calculated from first principles}, volume={253},
    DOI={<a href="https://doi.org/10.1002/pssb.201552576">10.1002/pssb.201552576</a>},
    number={4}, journal={Physica Status Solidi B}, publisher={Wiley-VCH}, author={Friedrich,
    Michael and Schindlmayr, Arno and Schmidt, Wolf Gero and Sanna, Simone}, year={2016},
    pages={683–689} }'
  chicago: 'Friedrich, Michael, Arno Schindlmayr, Wolf Gero Schmidt, and Simone Sanna.
    “LiTaO3 Phonon Dispersion and Ferroelectric Transition Calculated from First Principles.”
    <i>Physica Status Solidi B</i> 253, no. 4 (2016): 683–89. <a href="https://doi.org/10.1002/pssb.201552576">https://doi.org/10.1002/pssb.201552576</a>.'
  ieee: 'M. Friedrich, A. Schindlmayr, W. G. Schmidt, and S. Sanna, “LiTaO3 phonon
    dispersion and ferroelectric transition calculated from first principles,” <i>Physica
    Status Solidi B</i>, vol. 253, no. 4, pp. 683–689, 2016, doi: <a href="https://doi.org/10.1002/pssb.201552576">10.1002/pssb.201552576</a>.'
  mla: Friedrich, Michael, et al. “LiTaO3 Phonon Dispersion and Ferroelectric Transition
    Calculated from First Principles.” <i>Physica Status Solidi B</i>, vol. 253, no.
    4, Wiley-VCH, 2016, pp. 683–89, doi:<a href="https://doi.org/10.1002/pssb.201552576">10.1002/pssb.201552576</a>.
  short: M. Friedrich, A. Schindlmayr, W.G. Schmidt, S. Sanna, Physica Status Solidi
    B 253 (2016) 683–689.
date_created: 2019-05-29T07:52:52Z
date_updated: 2025-12-05T09:58:55Z
ddc:
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- _id: '27'
doi: 10.1002/pssb.201552576
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  date_created: 2020-08-28T14:22:11Z
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  description: © 2015 WILEY‐VCH Verlag GmbH & Co. KGaA, Weinheim
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  file_name: pssb.201552576.pdf
  file_size: 402594
  relation: main_file
  title: LiTaO3 phonon dispersion and ferroelectric transition calculated from first
    principles
file_date_updated: 2020-08-30T14:41:39Z
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  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
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- _id: '55'
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publication: Physica Status Solidi B
publication_identifier:
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publication_status: published
publisher: Wiley-VCH
quality_controlled: '1'
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title: LiTaO3 phonon dispersion and ferroelectric transition calculated from first
  principles
type: journal_article
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volume: 253
year: '2016'
...
---
_id: '13492'
article_number: '025704'
author:
- first_name: Stefano
  full_name: Tebi, Stefano
  last_name: Tebi
- first_name: Hazem
  full_name: Aldahhak, Hazem
  last_name: Aldahhak
- first_name: Giulia
  full_name: Serrano, Giulia
  last_name: Serrano
- first_name: Wolfgang
  full_name: Schöfberger, Wolfgang
  last_name: Schöfberger
- first_name: Eva
  full_name: Rauls, Eva
  last_name: Rauls
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: Reinhold
  full_name: Koch, Reinhold
  last_name: Koch
- first_name: Stefan
  full_name: Müllegger, Stefan
  last_name: Müllegger
citation:
  ama: Tebi S, Aldahhak H, Serrano G, et al. Manipulation resolves non-trivial structure
    of corrole monolayer on Ag(111). <i>Nanotechnology</i>. 2016;27. doi:<a href="https://doi.org/10.1088/0957-4484/27/2/025704">10.1088/0957-4484/27/2/025704</a>
  apa: Tebi, S., Aldahhak, H., Serrano, G., Schöfberger, W., Rauls, E., Schmidt, W.
    G., Koch, R., &#38; Müllegger, S. (2016). Manipulation resolves non-trivial structure
    of corrole monolayer on Ag(111). <i>Nanotechnology</i>, <i>27</i>, Article 025704.
    <a href="https://doi.org/10.1088/0957-4484/27/2/025704">https://doi.org/10.1088/0957-4484/27/2/025704</a>
  bibtex: '@article{Tebi_Aldahhak_Serrano_Schöfberger_Rauls_Schmidt_Koch_Müllegger_2016,
    title={Manipulation resolves non-trivial structure of corrole monolayer on Ag(111)},
    volume={27}, DOI={<a href="https://doi.org/10.1088/0957-4484/27/2/025704">10.1088/0957-4484/27/2/025704</a>},
    number={025704}, journal={Nanotechnology}, author={Tebi, Stefano and Aldahhak,
    Hazem and Serrano, Giulia and Schöfberger, Wolfgang and Rauls, Eva and Schmidt,
    Wolf Gero and Koch, Reinhold and Müllegger, Stefan}, year={2016} }'
  chicago: Tebi, Stefano, Hazem Aldahhak, Giulia Serrano, Wolfgang Schöfberger, Eva
    Rauls, Wolf Gero Schmidt, Reinhold Koch, and Stefan Müllegger. “Manipulation Resolves
    Non-Trivial Structure of Corrole Monolayer on Ag(111).” <i>Nanotechnology</i>
    27 (2016). <a href="https://doi.org/10.1088/0957-4484/27/2/025704">https://doi.org/10.1088/0957-4484/27/2/025704</a>.
  ieee: 'S. Tebi <i>et al.</i>, “Manipulation resolves non-trivial structure of corrole
    monolayer on Ag(111),” <i>Nanotechnology</i>, vol. 27, Art. no. 025704, 2016,
    doi: <a href="https://doi.org/10.1088/0957-4484/27/2/025704">10.1088/0957-4484/27/2/025704</a>.'
  mla: Tebi, Stefano, et al. “Manipulation Resolves Non-Trivial Structure of Corrole
    Monolayer on Ag(111).” <i>Nanotechnology</i>, vol. 27, 025704, 2016, doi:<a href="https://doi.org/10.1088/0957-4484/27/2/025704">10.1088/0957-4484/27/2/025704</a>.
  short: S. Tebi, H. Aldahhak, G. Serrano, W. Schöfberger, E. Rauls, W.G. Schmidt,
    R. Koch, S. Müllegger, Nanotechnology 27 (2016).
date_created: 2019-09-30T12:29:16Z
date_updated: 2025-12-05T10:20:57Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1088/0957-4484/27/2/025704
funded_apc: '1'
intvolume: '        27'
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Nanotechnology
publication_identifier:
  issn:
  - 0957-4484
  - 1361-6528
publication_status: published
status: public
title: Manipulation resolves non-trivial structure of corrole monolayer on Ag(111)
type: journal_article
user_id: '16199'
volume: 27
year: '2016'
...
---
_id: '13491'
author:
- first_name: Wolfgang
  full_name: Schöfberger, Wolfgang
  last_name: Schöfberger
- first_name: Felix
  full_name: Faschinger, Felix
  last_name: Faschinger
- first_name: Samir
  full_name: Chattopadhyay, Samir
  last_name: Chattopadhyay
- first_name: Snehadri
  full_name: Bhakta, Snehadri
  last_name: Bhakta
- first_name: Biswajit
  full_name: Mondal, Biswajit
  last_name: Mondal
- first_name: Johannes A. A. W.
  full_name: Elemans, Johannes A. A. W.
  last_name: Elemans
- first_name: Stefan
  full_name: Müllegger, Stefan
  last_name: Müllegger
- first_name: Stefano
  full_name: Tebi, Stefano
  last_name: Tebi
- first_name: Reinhold
  full_name: Koch, Reinhold
  last_name: Koch
- first_name: Florian
  full_name: Klappenberger, Florian
  last_name: Klappenberger
- first_name: Mateusz
  full_name: Paszkiewicz, Mateusz
  last_name: Paszkiewicz
- first_name: Johannes V.
  full_name: Barth, Johannes V.
  last_name: Barth
- first_name: Eva
  full_name: Rauls, Eva
  last_name: Rauls
- first_name: Hazem
  full_name: Aldahhak, Hazem
  last_name: Aldahhak
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: Abhishek
  full_name: Dey, Abhishek
  last_name: Dey
citation:
  ama: Schöfberger W, Faschinger F, Chattopadhyay S, et al. A Bifunctional Electrocatalyst
    for Oxygen Evolution and Oxygen Reduction Reactions in Water. <i>Angewandte Chemie
    International Edition</i>. Published online 2016:2350-2355. doi:<a href="https://doi.org/10.1002/anie.201508404">10.1002/anie.201508404</a>
  apa: Schöfberger, W., Faschinger, F., Chattopadhyay, S., Bhakta, S., Mondal, B.,
    Elemans, J. A. A. W., Müllegger, S., Tebi, S., Koch, R., Klappenberger, F., Paszkiewicz,
    M., Barth, J. V., Rauls, E., Aldahhak, H., Schmidt, W. G., &#38; Dey, A. (2016).
    A Bifunctional Electrocatalyst for Oxygen Evolution and Oxygen Reduction Reactions
    in Water. <i>Angewandte Chemie International Edition</i>, 2350–2355. <a href="https://doi.org/10.1002/anie.201508404">https://doi.org/10.1002/anie.201508404</a>
  bibtex: '@article{Schöfberger_Faschinger_Chattopadhyay_Bhakta_Mondal_Elemans_Müllegger_Tebi_Koch_Klappenberger_et
    al._2016, title={A Bifunctional Electrocatalyst for Oxygen Evolution and Oxygen
    Reduction Reactions in Water}, DOI={<a href="https://doi.org/10.1002/anie.201508404">10.1002/anie.201508404</a>},
    journal={Angewandte Chemie International Edition}, author={Schöfberger, Wolfgang
    and Faschinger, Felix and Chattopadhyay, Samir and Bhakta, Snehadri and Mondal,
    Biswajit and Elemans, Johannes A. A. W. and Müllegger, Stefan and Tebi, Stefano
    and Koch, Reinhold and Klappenberger, Florian and et al.}, year={2016}, pages={2350–2355}
    }'
  chicago: Schöfberger, Wolfgang, Felix Faschinger, Samir Chattopadhyay, Snehadri
    Bhakta, Biswajit Mondal, Johannes A. A. W. Elemans, Stefan Müllegger, et al. “A
    Bifunctional Electrocatalyst for Oxygen Evolution and Oxygen Reduction Reactions
    in Water.” <i>Angewandte Chemie International Edition</i>, 2016, 2350–55. <a href="https://doi.org/10.1002/anie.201508404">https://doi.org/10.1002/anie.201508404</a>.
  ieee: 'W. Schöfberger <i>et al.</i>, “A Bifunctional Electrocatalyst for Oxygen
    Evolution and Oxygen Reduction Reactions in Water,” <i>Angewandte Chemie International
    Edition</i>, pp. 2350–2355, 2016, doi: <a href="https://doi.org/10.1002/anie.201508404">10.1002/anie.201508404</a>.'
  mla: Schöfberger, Wolfgang, et al. “A Bifunctional Electrocatalyst for Oxygen Evolution
    and Oxygen Reduction Reactions in Water.” <i>Angewandte Chemie International Edition</i>,
    2016, pp. 2350–55, doi:<a href="https://doi.org/10.1002/anie.201508404">10.1002/anie.201508404</a>.
  short: W. Schöfberger, F. Faschinger, S. Chattopadhyay, S. Bhakta, B. Mondal, J.A.A.W.
    Elemans, S. Müllegger, S. Tebi, R. Koch, F. Klappenberger, M. Paszkiewicz, J.V.
    Barth, E. Rauls, H. Aldahhak, W.G. Schmidt, A. Dey, Angewandte Chemie International
    Edition (2016) 2350–2355.
date_created: 2019-09-30T12:27:10Z
date_updated: 2025-12-05T10:21:25Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
doi: 10.1002/anie.201508404
language:
- iso: eng
page: 2350-2355
publication: Angewandte Chemie International Edition
publication_identifier:
  issn:
  - 1433-7851
publication_status: published
status: public
title: A Bifunctional Electrocatalyst for Oxygen Evolution and Oxygen Reduction Reactions
  in Water
type: journal_article
user_id: '16199'
year: '2016'
...