---
_id: '34307'
abstract:
- lang: eng
  text: <p>“On-the-fly” coupled cluster-based path-integral molecular dynamics simulations
    predict that the effective potential of the protonated water–dimer has a single-well
    only.</p>
author:
- first_name: Thomas
  full_name: Spura, Thomas
  last_name: Spura
- first_name: Hossam
  full_name: Elgabarty, Hossam
  id: '60250'
  last_name: Elgabarty
  orcid: 0000-0002-4945-1481
- first_name: Thomas
  full_name: Kühne, Thomas
  id: '49079'
  last_name: Kühne
citation:
  ama: 'Spura T, Elgabarty H, Kühne T. “On-the-fly” coupled cluster path-integral
    molecular dynamics: impact of nuclear quantum effects on the protonated water
    dimer. <i>Physical Chemistry Chemical Physics</i>. 2015;17(22):14355-14359. doi:<a
    href="https://doi.org/10.1039/c4cp05192k">10.1039/c4cp05192k</a>'
  apa: 'Spura, T., Elgabarty, H., &#38; Kühne, T. (2015). “On-the-fly” coupled cluster
    path-integral molecular dynamics: impact of nuclear quantum effects on the protonated
    water dimer. <i>Physical Chemistry Chemical Physics</i>, <i>17</i>(22), 14355–14359.
    <a href="https://doi.org/10.1039/c4cp05192k">https://doi.org/10.1039/c4cp05192k</a>'
  bibtex: '@article{Spura_Elgabarty_Kühne_2015, title={“On-the-fly” coupled cluster
    path-integral molecular dynamics: impact of nuclear quantum effects on the protonated
    water dimer}, volume={17}, DOI={<a href="https://doi.org/10.1039/c4cp05192k">10.1039/c4cp05192k</a>},
    number={22}, journal={Physical Chemistry Chemical Physics}, publisher={Royal Society
    of Chemistry (RSC)}, author={Spura, Thomas and Elgabarty, Hossam and Kühne, Thomas},
    year={2015}, pages={14355–14359} }'
  chicago: 'Spura, Thomas, Hossam Elgabarty, and Thomas Kühne. “‘On-the-Fly’ Coupled
    Cluster Path-Integral Molecular Dynamics: Impact of Nuclear Quantum Effects on
    the Protonated Water Dimer.” <i>Physical Chemistry Chemical Physics</i> 17, no.
    22 (2015): 14355–59. <a href="https://doi.org/10.1039/c4cp05192k">https://doi.org/10.1039/c4cp05192k</a>.'
  ieee: 'T. Spura, H. Elgabarty, and T. Kühne, “‘On-the-fly’ coupled cluster path-integral
    molecular dynamics: impact of nuclear quantum effects on the protonated water
    dimer,” <i>Physical Chemistry Chemical Physics</i>, vol. 17, no. 22, pp. 14355–14359,
    2015, doi: <a href="https://doi.org/10.1039/c4cp05192k">10.1039/c4cp05192k</a>.'
  mla: 'Spura, Thomas, et al. “‘On-the-Fly’ Coupled Cluster Path-Integral Molecular
    Dynamics: Impact of Nuclear Quantum Effects on the Protonated Water Dimer.” <i>Physical
    Chemistry Chemical Physics</i>, vol. 17, no. 22, Royal Society of Chemistry (RSC),
    2015, pp. 14355–59, doi:<a href="https://doi.org/10.1039/c4cp05192k">10.1039/c4cp05192k</a>.'
  short: T. Spura, H. Elgabarty, T. Kühne, Physical Chemistry Chemical Physics 17
    (2015) 14355–14359.
date_created: 2022-12-09T12:12:11Z
date_updated: 2022-12-09T12:19:55Z
doi: 10.1039/c4cp05192k
intvolume: '        17'
issue: '22'
keyword:
- Physical and Theoretical Chemistry
- General Physics and Astronomy
language:
- iso: eng
page: 14355-14359
publication: Physical Chemistry Chemical Physics
publication_identifier:
  issn:
  - 1463-9076
  - 1463-9084
publication_status: published
publisher: Royal Society of Chemistry (RSC)
status: public
title: '“On-the-fly” coupled cluster path-integral molecular dynamics: impact of nuclear
  quantum effects on the protonated water dimer'
type: journal_article
user_id: '60250'
volume: 17
year: '2015'
...
---
_id: '41060'
abstract:
- lang: eng
  text: <p>We apply high-energy-resolution fluorescence-detected (HERFD) X-ray absorption
    near-edge structure (XANES) spectroscopy to study iron carbonyl complexes.</p>
author:
- first_name: Andrew J.
  full_name: Atkins, Andrew J.
  last_name: Atkins
- first_name: Matthias
  full_name: Bauer, Matthias
  id: '47241'
  last_name: Bauer
  orcid: 0000-0002-9294-6076
- first_name: Christoph R.
  full_name: Jacob, Christoph R.
  last_name: Jacob
citation:
  ama: Atkins AJ, Bauer M, Jacob CR. High-resolution X-ray absorption spectroscopy
    of iron carbonyl complexes. <i>Physical Chemistry Chemical Physics</i>. 2015;17(21):13937-13948.
    doi:<a href="https://doi.org/10.1039/c5cp01045d">10.1039/c5cp01045d</a>
  apa: Atkins, A. J., Bauer, M., &#38; Jacob, C. R. (2015). High-resolution X-ray
    absorption spectroscopy of iron carbonyl complexes. <i>Physical Chemistry Chemical
    Physics</i>, <i>17</i>(21), 13937–13948. <a href="https://doi.org/10.1039/c5cp01045d">https://doi.org/10.1039/c5cp01045d</a>
  bibtex: '@article{Atkins_Bauer_Jacob_2015, title={High-resolution X-ray absorption
    spectroscopy of iron carbonyl complexes}, volume={17}, DOI={<a href="https://doi.org/10.1039/c5cp01045d">10.1039/c5cp01045d</a>},
    number={21}, journal={Physical Chemistry Chemical Physics}, publisher={Royal Society
    of Chemistry (RSC)}, author={Atkins, Andrew J. and Bauer, Matthias and Jacob,
    Christoph R.}, year={2015}, pages={13937–13948} }'
  chicago: 'Atkins, Andrew J., Matthias Bauer, and Christoph R. Jacob. “High-Resolution
    X-Ray Absorption Spectroscopy of Iron Carbonyl Complexes.” <i>Physical Chemistry
    Chemical Physics</i> 17, no. 21 (2015): 13937–48. <a href="https://doi.org/10.1039/c5cp01045d">https://doi.org/10.1039/c5cp01045d</a>.'
  ieee: 'A. J. Atkins, M. Bauer, and C. R. Jacob, “High-resolution X-ray absorption
    spectroscopy of iron carbonyl complexes,” <i>Physical Chemistry Chemical Physics</i>,
    vol. 17, no. 21, pp. 13937–13948, 2015, doi: <a href="https://doi.org/10.1039/c5cp01045d">10.1039/c5cp01045d</a>.'
  mla: Atkins, Andrew J., et al. “High-Resolution X-Ray Absorption Spectroscopy of
    Iron Carbonyl Complexes.” <i>Physical Chemistry Chemical Physics</i>, vol. 17,
    no. 21, Royal Society of Chemistry (RSC), 2015, pp. 13937–48, doi:<a href="https://doi.org/10.1039/c5cp01045d">10.1039/c5cp01045d</a>.
  short: A.J. Atkins, M. Bauer, C.R. Jacob, Physical Chemistry Chemical Physics 17
    (2015) 13937–13948.
date_created: 2023-01-30T20:39:07Z
date_updated: 2023-01-31T08:36:22Z
department:
- _id: '35'
- _id: '306'
doi: 10.1039/c5cp01045d
intvolume: '        17'
issue: '21'
keyword:
- Physical and Theoretical Chemistry
- General Physics and Astronomy
language:
- iso: eng
page: 13937-13948
publication: Physical Chemistry Chemical Physics
publication_identifier:
  issn:
  - 1463-9076
  - 1463-9084
publication_status: published
publisher: Royal Society of Chemistry (RSC)
status: public
title: High-resolution X-ray absorption spectroscopy of iron carbonyl complexes
type: journal_article
user_id: '27611'
volume: 17
year: '2015'
...
---
_id: '25940'
abstract:
- lang: eng
  text: Metal–organic frameworks (MOFs) are crystalline microporous materials with
    tunable chemical and physical properties. By combining various metal clusters
    with different interconnecting organic linkers, the pore structure, crystallinity,
    as well as the surface properties can be modified. In the present work, modification
    of the organic linker molecules is utilized to synthesize CAU-10 type MOFs with
    variable affinity of the pore surface to water. In principle, this should influence
    the accessibility of the pores for water vapor and therefore offer a tool to control
    its sorption properties. For a deeper understanding we studied the water sorption
    characteristics and compared the results to the conductive and dielectric properties
    studied by impedance spectroscopy. Spectra in a wide frequency range from 1 mHz
    to 1 MHz were recorded. Data analysis is performed using the Havriliak–Negami
    model. The MOFs are also tested as sensitive layers for capacitive humidity sensing
    by correlating the change in permittivity of the materials with the amount of
    physisorbed water. Such an MOF-based sensor was tested with respect to environmental
    monitoring and compared to a commonly used commercial humidity sensor.
article_type: original
author:
- first_name: Alexander
  full_name: Weiss, Alexander
  last_name: Weiss
- first_name: Nele
  full_name: Reimer, Nele
  last_name: Reimer
- first_name: Norbert
  full_name: Stock, Norbert
  last_name: Stock
- first_name: Michael
  full_name: Tiemann, Michael
  id: '23547'
  last_name: Tiemann
  orcid: 0000-0003-1711-2722
- first_name: Thorsten
  full_name: Wagner, Thorsten
  last_name: Wagner
citation:
  ama: 'Weiss A, Reimer N, Stock N, Tiemann M, Wagner T. Surface-modified CAU-10 MOF
    materials as humidity sensors: impedance spectroscopic study on water uptake.
    <i>Physical Chemistry Chemical Physics</i>. Published online 2015:21634-21642.
    doi:<a href="https://doi.org/10.1039/c5cp01988e">10.1039/c5cp01988e</a>'
  apa: 'Weiss, A., Reimer, N., Stock, N., Tiemann, M., &#38; Wagner, T. (2015). Surface-modified
    CAU-10 MOF materials as humidity sensors: impedance spectroscopic study on water
    uptake. <i>Physical Chemistry Chemical Physics</i>, 21634–21642. <a href="https://doi.org/10.1039/c5cp01988e">https://doi.org/10.1039/c5cp01988e</a>'
  bibtex: '@article{Weiss_Reimer_Stock_Tiemann_Wagner_2015, title={Surface-modified
    CAU-10 MOF materials as humidity sensors: impedance spectroscopic study on water
    uptake}, DOI={<a href="https://doi.org/10.1039/c5cp01988e">10.1039/c5cp01988e</a>},
    journal={Physical Chemistry Chemical Physics}, author={Weiss, Alexander and Reimer,
    Nele and Stock, Norbert and Tiemann, Michael and Wagner, Thorsten}, year={2015},
    pages={21634–21642} }'
  chicago: 'Weiss, Alexander, Nele Reimer, Norbert Stock, Michael Tiemann, and Thorsten
    Wagner. “Surface-Modified CAU-10 MOF Materials as Humidity Sensors: Impedance
    Spectroscopic Study on Water Uptake.” <i>Physical Chemistry Chemical Physics</i>,
    2015, 21634–42. <a href="https://doi.org/10.1039/c5cp01988e">https://doi.org/10.1039/c5cp01988e</a>.'
  ieee: 'A. Weiss, N. Reimer, N. Stock, M. Tiemann, and T. Wagner, “Surface-modified
    CAU-10 MOF materials as humidity sensors: impedance spectroscopic study on water
    uptake,” <i>Physical Chemistry Chemical Physics</i>, pp. 21634–21642, 2015, doi:
    <a href="https://doi.org/10.1039/c5cp01988e">10.1039/c5cp01988e</a>.'
  mla: 'Weiss, Alexander, et al. “Surface-Modified CAU-10 MOF Materials as Humidity
    Sensors: Impedance Spectroscopic Study on Water Uptake.” <i>Physical Chemistry
    Chemical Physics</i>, 2015, pp. 21634–42, doi:<a href="https://doi.org/10.1039/c5cp01988e">10.1039/c5cp01988e</a>.'
  short: A. Weiss, N. Reimer, N. Stock, M. Tiemann, T. Wagner, Physical Chemistry
    Chemical Physics (2015) 21634–21642.
date_created: 2021-10-08T15:47:59Z
date_updated: 2023-03-08T10:28:19Z
department:
- _id: '35'
- _id: '2'
- _id: '307'
doi: 10.1039/c5cp01988e
language:
- iso: eng
main_file_link:
- open_access: '1'
  url: https://pubs.rsc.org/en/content/articlepdf/2015/cp/c5cp01988e
oa: '1'
page: 21634-21642
publication: Physical Chemistry Chemical Physics
publication_identifier:
  issn:
  - 1463-9076
  - 1463-9084
publication_status: published
quality_controlled: '1'
status: public
title: 'Surface-modified CAU-10 MOF materials as humidity sensors: impedance spectroscopic
  study on water uptake'
type: journal_article
user_id: '23547'
year: '2015'
...
---
_id: '13505'
abstract:
- lang: eng
  text: <p>First-principles calculations were combined with scanning tunneling microscopy
    (STM) measurements to analyze the adsorption of diindenoperylene (DIP) molecules
    on Cu(111) surfaces.</p>
author:
- first_name: Hazem
  full_name: Aldahhak, Hazem
  id: '26687'
  last_name: Aldahhak
- first_name: S.
  full_name: Matencio, S.
  last_name: Matencio
- first_name: E.
  full_name: Barrena, E.
  last_name: Barrena
- first_name: C.
  full_name: Ocal, C.
  last_name: Ocal
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: E.
  full_name: Rauls, E.
  last_name: Rauls
citation:
  ama: Aldahhak H, Matencio S, Barrena E, Ocal C, Schmidt WG, Rauls E. Structure formation
    in diindenoperylene thin films on copper(111). <i>Physical Chemistry Chemical
    Physics</i>. 2015;17:8776-8783. doi:<a href="https://doi.org/10.1039/c4cp05271d">10.1039/c4cp05271d</a>
  apa: Aldahhak, H., Matencio, S., Barrena, E., Ocal, C., Schmidt, W. G., &#38; Rauls,
    E. (2015). Structure formation in diindenoperylene thin films on copper(111).
    <i>Physical Chemistry Chemical Physics</i>, <i>17</i>, 8776–8783. <a href="https://doi.org/10.1039/c4cp05271d">https://doi.org/10.1039/c4cp05271d</a>
  bibtex: '@article{Aldahhak_Matencio_Barrena_Ocal_Schmidt_Rauls_2015, title={Structure
    formation in diindenoperylene thin films on copper(111)}, volume={17}, DOI={<a
    href="https://doi.org/10.1039/c4cp05271d">10.1039/c4cp05271d</a>}, journal={Physical
    Chemistry Chemical Physics}, author={Aldahhak, Hazem and Matencio, S. and Barrena,
    E. and Ocal, C. and Schmidt, Wolf Gero and Rauls, E.}, year={2015}, pages={8776–8783}
    }'
  chicago: 'Aldahhak, Hazem, S. Matencio, E. Barrena, C. Ocal, Wolf Gero Schmidt,
    and E. Rauls. “Structure Formation in Diindenoperylene Thin Films on Copper(111).”
    <i>Physical Chemistry Chemical Physics</i> 17 (2015): 8776–83. <a href="https://doi.org/10.1039/c4cp05271d">https://doi.org/10.1039/c4cp05271d</a>.'
  ieee: 'H. Aldahhak, S. Matencio, E. Barrena, C. Ocal, W. G. Schmidt, and E. Rauls,
    “Structure formation in diindenoperylene thin films on copper(111),” <i>Physical
    Chemistry Chemical Physics</i>, vol. 17, pp. 8776–8783, 2015, doi: <a href="https://doi.org/10.1039/c4cp05271d">10.1039/c4cp05271d</a>.'
  mla: Aldahhak, Hazem, et al. “Structure Formation in Diindenoperylene Thin Films
    on Copper(111).” <i>Physical Chemistry Chemical Physics</i>, vol. 17, 2015, pp.
    8776–83, doi:<a href="https://doi.org/10.1039/c4cp05271d">10.1039/c4cp05271d</a>.
  short: H. Aldahhak, S. Matencio, E. Barrena, C. Ocal, W.G. Schmidt, E. Rauls, Physical
    Chemistry Chemical Physics 17 (2015) 8776–8783.
date_created: 2019-09-30T13:15:09Z
date_updated: 2025-12-05T10:36:44Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
doi: 10.1039/c4cp05271d
intvolume: '        17'
language:
- iso: eng
page: 8776-8783
publication: Physical Chemistry Chemical Physics
publication_identifier:
  issn:
  - 1463-9076
  - 1463-9084
publication_status: published
status: public
title: Structure formation in diindenoperylene thin films on copper(111)
type: journal_article
user_id: '16199'
volume: 17
year: '2015'
...
---
_id: '13503'
abstract:
- lang: eng
  text: <p>First-principles calculations were combined with scanning tunneling microscopy
    (STM) measurements to analyze the adsorption of diindenoperylene (DIP) molecules
    on Cu(111) surfaces.</p>
author:
- first_name: Hazem
  full_name: Aldahhak, Hazem
  last_name: Aldahhak
- first_name: S.
  full_name: Matencio, S.
  last_name: Matencio
- first_name: E.
  full_name: Barrena, E.
  last_name: Barrena
- first_name: C.
  full_name: Ocal, C.
  last_name: Ocal
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: E.
  full_name: Rauls, E.
  last_name: Rauls
citation:
  ama: Aldahhak H, Matencio S, Barrena E, Ocal C, Schmidt WG, Rauls E. Structure formation
    in diindenoperylene thin films on copper(111). <i>Physical Chemistry Chemical
    Physics</i>. 2015;17:8776-8783. doi:<a href="https://doi.org/10.1039/c4cp05271d">10.1039/c4cp05271d</a>
  apa: Aldahhak, H., Matencio, S., Barrena, E., Ocal, C., Schmidt, W. G., &#38; Rauls,
    E. (2015). Structure formation in diindenoperylene thin films on copper(111).
    <i>Physical Chemistry Chemical Physics</i>, <i>17</i>, 8776–8783. <a href="https://doi.org/10.1039/c4cp05271d">https://doi.org/10.1039/c4cp05271d</a>
  bibtex: '@article{Aldahhak_Matencio_Barrena_Ocal_Schmidt_Rauls_2015, title={Structure
    formation in diindenoperylene thin films on copper(111)}, volume={17}, DOI={<a
    href="https://doi.org/10.1039/c4cp05271d">10.1039/c4cp05271d</a>}, journal={Physical
    Chemistry Chemical Physics}, author={Aldahhak, Hazem and Matencio, S. and Barrena,
    E. and Ocal, C. and Schmidt, Wolf Gero and Rauls, E.}, year={2015}, pages={8776–8783}
    }'
  chicago: 'Aldahhak, Hazem, S. Matencio, E. Barrena, C. Ocal, Wolf Gero Schmidt,
    and E. Rauls. “Structure Formation in Diindenoperylene Thin Films on Copper(111).”
    <i>Physical Chemistry Chemical Physics</i> 17 (2015): 8776–83. <a href="https://doi.org/10.1039/c4cp05271d">https://doi.org/10.1039/c4cp05271d</a>.'
  ieee: 'H. Aldahhak, S. Matencio, E. Barrena, C. Ocal, W. G. Schmidt, and E. Rauls,
    “Structure formation in diindenoperylene thin films on copper(111),” <i>Physical
    Chemistry Chemical Physics</i>, vol. 17, pp. 8776–8783, 2015, doi: <a href="https://doi.org/10.1039/c4cp05271d">10.1039/c4cp05271d</a>.'
  mla: Aldahhak, Hazem, et al. “Structure Formation in Diindenoperylene Thin Films
    on Copper(111).” <i>Physical Chemistry Chemical Physics</i>, vol. 17, 2015, pp.
    8776–83, doi:<a href="https://doi.org/10.1039/c4cp05271d">10.1039/c4cp05271d</a>.
  short: H. Aldahhak, S. Matencio, E. Barrena, C. Ocal, W.G. Schmidt, E. Rauls, Physical
    Chemistry Chemical Physics 17 (2015) 8776–8783.
date_created: 2019-09-30T13:03:08Z
date_updated: 2025-12-05T10:37:42Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
- _id: '230'
doi: 10.1039/c4cp05271d
intvolume: '        17'
language:
- iso: eng
page: 8776-8783
publication: Physical Chemistry Chemical Physics
publication_identifier:
  issn:
  - 1463-9076
  - 1463-9084
publication_status: published
status: public
title: Structure formation in diindenoperylene thin films on copper(111)
type: journal_article
user_id: '16199'
volume: 17
year: '2015'
...
---
_id: '34311'
abstract:
- lang: eng
  text: <p>The chromophore phycocyanobilin changes its spectroscopic behaviour upon
    solvent change. Our calculations trace this effect back to conformational switching,
    induced by changes in the hydrogen bonding pattern.</p>
author:
- first_name: Tobias
  full_name: Watermann, Tobias
  last_name: Watermann
- first_name: Hossam
  full_name: Elgabarty, Hossam
  id: '60250'
  last_name: Elgabarty
  orcid: 0000-0002-4945-1481
- first_name: Daniel
  full_name: Sebastiani, Daniel
  last_name: Sebastiani
citation:
  ama: Watermann T, Elgabarty H, Sebastiani D. Phycocyanobilin in solution – a solvent
    triggered molecular switch. <i>Phys Chem Chem Phys</i>. 2014;16(13):6146-6152.
    doi:<a href="https://doi.org/10.1039/c3cp54307b">10.1039/c3cp54307b</a>
  apa: Watermann, T., Elgabarty, H., &#38; Sebastiani, D. (2014). Phycocyanobilin
    in solution – a solvent triggered molecular switch. <i>Phys. Chem. Chem. Phys.</i>,
    <i>16</i>(13), 6146–6152. <a href="https://doi.org/10.1039/c3cp54307b">https://doi.org/10.1039/c3cp54307b</a>
  bibtex: '@article{Watermann_Elgabarty_Sebastiani_2014, title={Phycocyanobilin in
    solution – a solvent triggered molecular switch}, volume={16}, DOI={<a href="https://doi.org/10.1039/c3cp54307b">10.1039/c3cp54307b</a>},
    number={13}, journal={Phys. Chem. Chem. Phys.}, publisher={Royal Society of Chemistry
    (RSC)}, author={Watermann, Tobias and Elgabarty, Hossam and Sebastiani, Daniel},
    year={2014}, pages={6146–6152} }'
  chicago: 'Watermann, Tobias, Hossam Elgabarty, and Daniel Sebastiani. “Phycocyanobilin
    in Solution – a Solvent Triggered Molecular Switch.” <i>Phys. Chem. Chem. Phys.</i>
    16, no. 13 (2014): 6146–52. <a href="https://doi.org/10.1039/c3cp54307b">https://doi.org/10.1039/c3cp54307b</a>.'
  ieee: 'T. Watermann, H. Elgabarty, and D. Sebastiani, “Phycocyanobilin in solution
    – a solvent triggered molecular switch,” <i>Phys. Chem. Chem. Phys.</i>, vol.
    16, no. 13, pp. 6146–6152, 2014, doi: <a href="https://doi.org/10.1039/c3cp54307b">10.1039/c3cp54307b</a>.'
  mla: Watermann, Tobias, et al. “Phycocyanobilin in Solution – a Solvent Triggered
    Molecular Switch.” <i>Phys. Chem. Chem. Phys.</i>, vol. 16, no. 13, Royal Society
    of Chemistry (RSC), 2014, pp. 6146–52, doi:<a href="https://doi.org/10.1039/c3cp54307b">10.1039/c3cp54307b</a>.
  short: T. Watermann, H. Elgabarty, D. Sebastiani, Phys. Chem. Chem. Phys. 16 (2014)
    6146–6152.
date_created: 2022-12-09T12:16:16Z
date_updated: 2022-12-09T12:16:23Z
doi: 10.1039/c3cp54307b
intvolume: '        16'
issue: '13'
keyword:
- Physical and Theoretical Chemistry
- General Physics and Astronomy
language:
- iso: eng
page: 6146-6152
publication: Phys. Chem. Chem. Phys.
publication_identifier:
  issn:
  - 1463-9076
  - 1463-9084
publication_status: published
publisher: Royal Society of Chemistry (RSC)
status: public
title: Phycocyanobilin in solution – a solvent triggered molecular switch
type: journal_article
user_id: '60250'
volume: 16
year: '2014'
...
---
_id: '41225'
abstract:
- lang: eng
  text: <p>This perspective accounts for the benefits of the high resolution hard
    X-ray spectroscopic methods HERFD-XANES and valence-to-core-XES.</p>
author:
- first_name: Matthias
  full_name: Bauer, Matthias
  id: '47241'
  last_name: Bauer
  orcid: 0000-0002-9294-6076
citation:
  ama: 'Bauer M. HERFD-XAS and valence-to-core-XES: new tools to push the limits in
    research with hard X-rays? <i>Phys Chem Chem Phys</i>. 2014;16(27):13827-13837.
    doi:<a href="https://doi.org/10.1039/c4cp00904e">10.1039/c4cp00904e</a>'
  apa: 'Bauer, M. (2014). HERFD-XAS and valence-to-core-XES: new tools to push the
    limits in research with hard X-rays? <i>Phys. Chem. Chem. Phys.</i>, <i>16</i>(27),
    13827–13837. <a href="https://doi.org/10.1039/c4cp00904e">https://doi.org/10.1039/c4cp00904e</a>'
  bibtex: '@article{Bauer_2014, title={HERFD-XAS and valence-to-core-XES: new tools
    to push the limits in research with hard X-rays?}, volume={16}, DOI={<a href="https://doi.org/10.1039/c4cp00904e">10.1039/c4cp00904e</a>},
    number={27}, journal={Phys. Chem. Chem. Phys.}, publisher={Royal Society of Chemistry
    (RSC)}, author={Bauer, Matthias}, year={2014}, pages={13827–13837} }'
  chicago: 'Bauer, Matthias. “HERFD-XAS and Valence-to-Core-XES: New Tools to Push
    the Limits in Research with Hard X-Rays?” <i>Phys. Chem. Chem. Phys.</i> 16, no.
    27 (2014): 13827–37. <a href="https://doi.org/10.1039/c4cp00904e">https://doi.org/10.1039/c4cp00904e</a>.'
  ieee: 'M. Bauer, “HERFD-XAS and valence-to-core-XES: new tools to push the limits
    in research with hard X-rays?,” <i>Phys. Chem. Chem. Phys.</i>, vol. 16, no. 27,
    pp. 13827–13837, 2014, doi: <a href="https://doi.org/10.1039/c4cp00904e">10.1039/c4cp00904e</a>.'
  mla: 'Bauer, Matthias. “HERFD-XAS and Valence-to-Core-XES: New Tools to Push the
    Limits in Research with Hard X-Rays?” <i>Phys. Chem. Chem. Phys.</i>, vol. 16,
    no. 27, Royal Society of Chemistry (RSC), 2014, pp. 13827–37, doi:<a href="https://doi.org/10.1039/c4cp00904e">10.1039/c4cp00904e</a>.'
  short: M. Bauer, Phys. Chem. Chem. Phys. 16 (2014) 13827–13837.
date_created: 2023-01-31T14:45:33Z
date_updated: 2023-01-31T14:48:29Z
department:
- _id: '306'
doi: 10.1039/c4cp00904e
intvolume: '        16'
issue: '27'
keyword:
- Physical and Theoretical Chemistry
- General Physics and Astronomy
language:
- iso: eng
page: 13827-13837
publication: Phys. Chem. Chem. Phys.
publication_identifier:
  issn:
  - 1463-9076
  - 1463-9084
publication_status: published
publisher: Royal Society of Chemistry (RSC)
status: public
title: 'HERFD-XAS and valence-to-core-XES: new tools to push the limits in research
  with hard X-rays?'
type: journal_article
user_id: '48467'
volume: 16
year: '2014'
...
---
_id: '7485'
author:
- first_name: Christian
  full_name: Wiebeler, Christian
  last_name: Wiebeler
- first_name: Christina A.
  full_name: Bader, Christina A.
  last_name: Bader
- first_name: Cedrik
  full_name: Meier, Cedrik
  id: '20798'
  last_name: Meier
  orcid: https://orcid.org/0000-0002-3787-3572
- first_name: Stefan
  full_name: Schumacher, Stefan
  id: '27271'
  last_name: Schumacher
  orcid: 0000-0003-4042-4951
citation:
  ama: Wiebeler C, Bader CA, Meier C, Schumacher S. Optical spectrum, perceived color,
    refractive index, and non-adiabatic dynamics of the photochromic diarylethene
    CMTE. <i>Phys Chem Chem Phys</i>. 2014;16(28):14531-14538. doi:<a href="https://doi.org/10.1039/c3cp55490b">10.1039/c3cp55490b</a>
  apa: Wiebeler, C., Bader, C. A., Meier, C., &#38; Schumacher, S. (2014). Optical
    spectrum, perceived color, refractive index, and non-adiabatic dynamics of the
    photochromic diarylethene CMTE. <i>Phys. Chem. Chem. Phys.</i>, <i>16</i>(28),
    14531–14538. <a href="https://doi.org/10.1039/c3cp55490b">https://doi.org/10.1039/c3cp55490b</a>
  bibtex: '@article{Wiebeler_Bader_Meier_Schumacher_2014, title={Optical spectrum,
    perceived color, refractive index, and non-adiabatic dynamics of the photochromic
    diarylethene CMTE}, volume={16}, DOI={<a href="https://doi.org/10.1039/c3cp55490b">10.1039/c3cp55490b</a>},
    number={28}, journal={Phys. Chem. Chem. Phys.}, publisher={Royal Society of Chemistry
    (RSC)}, author={Wiebeler, Christian and Bader, Christina A. and Meier, Cedrik
    and Schumacher, Stefan}, year={2014}, pages={14531–14538} }'
  chicago: 'Wiebeler, Christian, Christina A. Bader, Cedrik Meier, and Stefan Schumacher.
    “Optical Spectrum, Perceived Color, Refractive Index, and Non-Adiabatic Dynamics
    of the Photochromic Diarylethene CMTE.” <i>Phys. Chem. Chem. Phys.</i> 16, no.
    28 (2014): 14531–38. <a href="https://doi.org/10.1039/c3cp55490b">https://doi.org/10.1039/c3cp55490b</a>.'
  ieee: 'C. Wiebeler, C. A. Bader, C. Meier, and S. Schumacher, “Optical spectrum,
    perceived color, refractive index, and non-adiabatic dynamics of the photochromic
    diarylethene CMTE,” <i>Phys. Chem. Chem. Phys.</i>, vol. 16, no. 28, pp. 14531–14538,
    2014, doi: <a href="https://doi.org/10.1039/c3cp55490b">10.1039/c3cp55490b</a>.'
  mla: Wiebeler, Christian, et al. “Optical Spectrum, Perceived Color, Refractive
    Index, and Non-Adiabatic Dynamics of the Photochromic Diarylethene CMTE.” <i>Phys.
    Chem. Chem. Phys.</i>, vol. 16, no. 28, Royal Society of Chemistry (RSC), 2014,
    pp. 14531–38, doi:<a href="https://doi.org/10.1039/c3cp55490b">10.1039/c3cp55490b</a>.
  short: C. Wiebeler, C.A. Bader, C. Meier, S. Schumacher, Phys. Chem. Chem. Phys.
    16 (2014) 14531–14538.
date_created: 2019-02-04T14:09:21Z
date_updated: 2025-12-05T14:49:36Z
department:
- _id: '15'
- _id: '230'
- _id: '35'
- _id: '287'
- _id: '170'
- _id: '297'
doi: 10.1039/c3cp55490b
intvolume: '        16'
issue: '28'
language:
- iso: eng
page: 14531-14538
publication: Phys. Chem. Chem. Phys.
publication_identifier:
  issn:
  - 1463-9076
  - 1463-9084
publication_status: published
publisher: Royal Society of Chemistry (RSC)
status: public
title: Optical spectrum, perceived color, refractive index, and non-adiabatic dynamics
  of the photochromic diarylethene CMTE
type: journal_article
user_id: '16199'
volume: 16
year: '2014'
...
---
_id: '34312'
article_number: '16082'
author:
- first_name: Hossam
  full_name: Elgabarty, Hossam
  id: '60250'
  last_name: Elgabarty
  orcid: 0000-0002-4945-1481
- first_name: Milian
  full_name: Wolff, Milian
  last_name: Wolff
- first_name: Adrian
  full_name: Glaubitz, Adrian
  last_name: Glaubitz
- first_name: Dariush
  full_name: Hinderberger, Dariush
  last_name: Hinderberger
- first_name: Daniel
  full_name: Sebastiani, Daniel
  last_name: Sebastiani
citation:
  ama: Elgabarty H, Wolff M, Glaubitz A, Hinderberger D, Sebastiani D. First principles
    calculation of inhomogeneous broadening in solid-state cw-EPR spectroscopy. <i>Physical
    Chemistry Chemical Physics</i>. 2013;15(38). doi:<a href="https://doi.org/10.1039/c3cp51938d">10.1039/c3cp51938d</a>
  apa: Elgabarty, H., Wolff, M., Glaubitz, A., Hinderberger, D., &#38; Sebastiani,
    D. (2013). First principles calculation of inhomogeneous broadening in solid-state
    cw-EPR spectroscopy. <i>Physical Chemistry Chemical Physics</i>, <i>15</i>(38),
    Article 16082. <a href="https://doi.org/10.1039/c3cp51938d">https://doi.org/10.1039/c3cp51938d</a>
  bibtex: '@article{Elgabarty_Wolff_Glaubitz_Hinderberger_Sebastiani_2013, title={First
    principles calculation of inhomogeneous broadening in solid-state cw-EPR spectroscopy},
    volume={15}, DOI={<a href="https://doi.org/10.1039/c3cp51938d">10.1039/c3cp51938d</a>},
    number={3816082}, journal={Physical Chemistry Chemical Physics}, publisher={Royal
    Society of Chemistry (RSC)}, author={Elgabarty, Hossam and Wolff, Milian and Glaubitz,
    Adrian and Hinderberger, Dariush and Sebastiani, Daniel}, year={2013} }'
  chicago: Elgabarty, Hossam, Milian Wolff, Adrian Glaubitz, Dariush Hinderberger,
    and Daniel Sebastiani. “First Principles Calculation of Inhomogeneous Broadening
    in Solid-State Cw-EPR Spectroscopy.” <i>Physical Chemistry Chemical Physics</i>
    15, no. 38 (2013). <a href="https://doi.org/10.1039/c3cp51938d">https://doi.org/10.1039/c3cp51938d</a>.
  ieee: 'H. Elgabarty, M. Wolff, A. Glaubitz, D. Hinderberger, and D. Sebastiani,
    “First principles calculation of inhomogeneous broadening in solid-state cw-EPR
    spectroscopy,” <i>Physical Chemistry Chemical Physics</i>, vol. 15, no. 38, Art.
    no. 16082, 2013, doi: <a href="https://doi.org/10.1039/c3cp51938d">10.1039/c3cp51938d</a>.'
  mla: Elgabarty, Hossam, et al. “First Principles Calculation of Inhomogeneous Broadening
    in Solid-State Cw-EPR Spectroscopy.” <i>Physical Chemistry Chemical Physics</i>,
    vol. 15, no. 38, 16082, Royal Society of Chemistry (RSC), 2013, doi:<a href="https://doi.org/10.1039/c3cp51938d">10.1039/c3cp51938d</a>.
  short: H. Elgabarty, M. Wolff, A. Glaubitz, D. Hinderberger, D. Sebastiani, Physical
    Chemistry Chemical Physics 15 (2013).
date_created: 2022-12-09T12:16:29Z
date_updated: 2022-12-09T12:16:34Z
doi: 10.1039/c3cp51938d
intvolume: '        15'
issue: '38'
keyword:
- Physical and Theoretical Chemistry
- General Physics and Astronomy
language:
- iso: eng
publication: Physical Chemistry Chemical Physics
publication_identifier:
  issn:
  - 1463-9076
  - 1463-9084
publication_status: published
publisher: Royal Society of Chemistry (RSC)
status: public
title: First principles calculation of inhomogeneous broadening in solid-state cw-EPR
  spectroscopy
type: journal_article
user_id: '60250'
volume: 15
year: '2013'
...
---
_id: '41235'
article_number: '8095'
author:
- first_name: Andrew J.
  full_name: Atkins, Andrew J.
  last_name: Atkins
- first_name: Matthias
  full_name: Bauer, Matthias
  id: '47241'
  last_name: Bauer
  orcid: 0000-0002-9294-6076
- first_name: Christoph R.
  full_name: Jacob, Christoph R.
  last_name: Jacob
citation:
  ama: 'Atkins AJ, Bauer M, Jacob CR. The chemical sensitivity of X-ray spectroscopy:
    high energy resolution XANES versus X-ray emission spectroscopy of substituted
    ferrocenes. <i>Physical Chemistry Chemical Physics</i>. 2013;15(21). doi:<a href="https://doi.org/10.1039/c3cp50999k">10.1039/c3cp50999k</a>'
  apa: 'Atkins, A. J., Bauer, M., &#38; Jacob, C. R. (2013). The chemical sensitivity
    of X-ray spectroscopy: high energy resolution XANES versus X-ray emission spectroscopy
    of substituted ferrocenes. <i>Physical Chemistry Chemical Physics</i>, <i>15</i>(21),
    Article 8095. <a href="https://doi.org/10.1039/c3cp50999k">https://doi.org/10.1039/c3cp50999k</a>'
  bibtex: '@article{Atkins_Bauer_Jacob_2013, title={The chemical sensitivity of X-ray
    spectroscopy: high energy resolution XANES versus X-ray emission spectroscopy
    of substituted ferrocenes}, volume={15}, DOI={<a href="https://doi.org/10.1039/c3cp50999k">10.1039/c3cp50999k</a>},
    number={218095}, journal={Physical Chemistry Chemical Physics}, publisher={Royal
    Society of Chemistry (RSC)}, author={Atkins, Andrew J. and Bauer, Matthias and
    Jacob, Christoph R.}, year={2013} }'
  chicago: 'Atkins, Andrew J., Matthias Bauer, and Christoph R. Jacob. “The Chemical
    Sensitivity of X-Ray Spectroscopy: High Energy Resolution XANES versus X-Ray Emission
    Spectroscopy of Substituted Ferrocenes.” <i>Physical Chemistry Chemical Physics</i>
    15, no. 21 (2013). <a href="https://doi.org/10.1039/c3cp50999k">https://doi.org/10.1039/c3cp50999k</a>.'
  ieee: 'A. J. Atkins, M. Bauer, and C. R. Jacob, “The chemical sensitivity of X-ray
    spectroscopy: high energy resolution XANES versus X-ray emission spectroscopy
    of substituted ferrocenes,” <i>Physical Chemistry Chemical Physics</i>, vol. 15,
    no. 21, Art. no. 8095, 2013, doi: <a href="https://doi.org/10.1039/c3cp50999k">10.1039/c3cp50999k</a>.'
  mla: 'Atkins, Andrew J., et al. “The Chemical Sensitivity of X-Ray Spectroscopy:
    High Energy Resolution XANES versus X-Ray Emission Spectroscopy of Substituted
    Ferrocenes.” <i>Physical Chemistry Chemical Physics</i>, vol. 15, no. 21, 8095,
    Royal Society of Chemistry (RSC), 2013, doi:<a href="https://doi.org/10.1039/c3cp50999k">10.1039/c3cp50999k</a>.'
  short: A.J. Atkins, M. Bauer, C.R. Jacob, Physical Chemistry Chemical Physics 15
    (2013).
date_created: 2023-01-31T14:50:33Z
date_updated: 2023-01-31T14:52:43Z
department:
- _id: '306'
doi: 10.1039/c3cp50999k
intvolume: '        15'
issue: '21'
keyword:
- Physical and Theoretical Chemistry
- General Physics and Astronomy
language:
- iso: eng
publication: Physical Chemistry Chemical Physics
publication_identifier:
  issn:
  - 1463-9076
  - 1463-9084
publication_status: published
publisher: Royal Society of Chemistry (RSC)
status: public
title: 'The chemical sensitivity of X-ray spectroscopy: high energy resolution XANES
  versus X-ray emission spectroscopy of substituted ferrocenes'
type: journal_article
user_id: '48467'
volume: 15
year: '2013'
...
---
_id: '15872'
article_number: '9176'
author:
- first_name: Neil A.
  full_name: Montgomery, Neil A.
  last_name: Montgomery
- first_name: Gordon J.
  full_name: Hedley, Gordon J.
  last_name: Hedley
- first_name: Arvydas
  full_name: Ruseckas, Arvydas
  last_name: Ruseckas
- first_name: Jean-Christophe
  full_name: Denis, Jean-Christophe
  last_name: Denis
- first_name: Stefan
  full_name: Schumacher, Stefan
  id: '27271'
  last_name: Schumacher
  orcid: 0000-0003-4042-4951
- first_name: Alexander L.
  full_name: Kanibolotsky, Alexander L.
  last_name: Kanibolotsky
- first_name: Peter J.
  full_name: Skabara, Peter J.
  last_name: Skabara
- first_name: Ian
  full_name: Galbraith, Ian
  last_name: Galbraith
- first_name: Graham A.
  full_name: Turnbull, Graham A.
  last_name: Turnbull
- first_name: Ifor D. W.
  full_name: Samuel, Ifor D. W.
  last_name: Samuel
citation:
  ama: Montgomery NA, Hedley GJ, Ruseckas A, et al. Dynamics of fluorescence depolarisation
    in star-shaped oligofluorene-truxene molecules. <i>Physical Chemistry Chemical
    Physics</i>. Published online 2012. doi:<a href="https://doi.org/10.1039/c2cp24141b">10.1039/c2cp24141b</a>
  apa: Montgomery, N. A., Hedley, G. J., Ruseckas, A., Denis, J.-C., Schumacher, S.,
    Kanibolotsky, A. L., Skabara, P. J., Galbraith, I., Turnbull, G. A., &#38; Samuel,
    I. D. W. (2012). Dynamics of fluorescence depolarisation in star-shaped oligofluorene-truxene
    molecules. <i>Physical Chemistry Chemical Physics</i>, Article 9176. <a href="https://doi.org/10.1039/c2cp24141b">https://doi.org/10.1039/c2cp24141b</a>
  bibtex: '@article{Montgomery_Hedley_Ruseckas_Denis_Schumacher_Kanibolotsky_Skabara_Galbraith_Turnbull_Samuel_2012,
    title={Dynamics of fluorescence depolarisation in star-shaped oligofluorene-truxene
    molecules}, DOI={<a href="https://doi.org/10.1039/c2cp24141b">10.1039/c2cp24141b</a>},
    number={9176}, journal={Physical Chemistry Chemical Physics}, author={Montgomery,
    Neil A. and Hedley, Gordon J. and Ruseckas, Arvydas and Denis, Jean-Christophe
    and Schumacher, Stefan and Kanibolotsky, Alexander L. and Skabara, Peter J. and
    Galbraith, Ian and Turnbull, Graham A. and Samuel, Ifor D. W.}, year={2012} }'
  chicago: Montgomery, Neil A., Gordon J. Hedley, Arvydas Ruseckas, Jean-Christophe
    Denis, Stefan Schumacher, Alexander L. Kanibolotsky, Peter J. Skabara, Ian Galbraith,
    Graham A. Turnbull, and Ifor D. W. Samuel. “Dynamics of Fluorescence Depolarisation
    in Star-Shaped Oligofluorene-Truxene Molecules.” <i>Physical Chemistry Chemical
    Physics</i>, 2012. <a href="https://doi.org/10.1039/c2cp24141b">https://doi.org/10.1039/c2cp24141b</a>.
  ieee: 'N. A. Montgomery <i>et al.</i>, “Dynamics of fluorescence depolarisation
    in star-shaped oligofluorene-truxene molecules,” <i>Physical Chemistry Chemical
    Physics</i>, Art. no. 9176, 2012, doi: <a href="https://doi.org/10.1039/c2cp24141b">10.1039/c2cp24141b</a>.'
  mla: Montgomery, Neil A., et al. “Dynamics of Fluorescence Depolarisation in Star-Shaped
    Oligofluorene-Truxene Molecules.” <i>Physical Chemistry Chemical Physics</i>,
    9176, 2012, doi:<a href="https://doi.org/10.1039/c2cp24141b">10.1039/c2cp24141b</a>.
  short: N.A. Montgomery, G.J. Hedley, A. Ruseckas, J.-C. Denis, S. Schumacher, A.L.
    Kanibolotsky, P.J. Skabara, I. Galbraith, G.A. Turnbull, I.D.W. Samuel, Physical
    Chemistry Chemical Physics (2012).
date_created: 2020-02-10T12:11:57Z
date_updated: 2025-12-16T08:03:17Z
department:
- _id: '15'
- _id: '170'
- _id: '297'
- _id: '35'
- _id: '230'
- _id: '27'
doi: 10.1039/c2cp24141b
language:
- iso: eng
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Physical Chemistry Chemical Physics
publication_identifier:
  issn:
  - 1463-9076
  - 1463-9084
publication_status: published
status: public
title: Dynamics of fluorescence depolarisation in star-shaped oligofluorene-truxene
  molecules
type: journal_article
user_id: '16199'
year: '2012'
...
---
_id: '41987'
author:
- first_name: Todor
  full_name: Hikov, Todor
  last_name: Hikov
- first_name: Christian A.
  full_name: Schröder, Christian A.
  last_name: Schröder
- first_name: Janosch
  full_name: Cravillon, Janosch
  last_name: Cravillon
- first_name: Michael
  full_name: Wiebcke, Michael
  last_name: Wiebcke
- first_name: Klaus
  full_name: Huber, Klaus
  id: '237'
  last_name: Huber
citation:
  ama: Hikov T, Schröder CA, Cravillon J, Wiebcke M, Huber K. In situ static and dynamic
    light scattering and scanning electron microscopy study on the crystallization
    of the dense zinc imidazolate framework ZIF-zni. <i>Phys Chem Chem Phys</i>. 2011;14(2):511-521.
    doi:<a href="https://doi.org/10.1039/c1cp22855b">10.1039/c1cp22855b</a>
  apa: Hikov, T., Schröder, C. A., Cravillon, J., Wiebcke, M., &#38; Huber, K. (2011).
    In situ static and dynamic light scattering and scanning electron microscopy study
    on the crystallization of the dense zinc imidazolate framework ZIF-zni. <i>Phys.
    Chem. Chem. Phys.</i>, <i>14</i>(2), 511–521. <a href="https://doi.org/10.1039/c1cp22855b">https://doi.org/10.1039/c1cp22855b</a>
  bibtex: '@article{Hikov_Schröder_Cravillon_Wiebcke_Huber_2011, title={In situ static
    and dynamic light scattering and scanning electron microscopy study on the crystallization
    of the dense zinc imidazolate framework ZIF-zni}, volume={14}, DOI={<a href="https://doi.org/10.1039/c1cp22855b">10.1039/c1cp22855b</a>},
    number={2}, journal={Phys. Chem. Chem. Phys.}, publisher={Royal Society of Chemistry
    (RSC)}, author={Hikov, Todor and Schröder, Christian A. and Cravillon, Janosch
    and Wiebcke, Michael and Huber, Klaus}, year={2011}, pages={511–521} }'
  chicago: 'Hikov, Todor, Christian A. Schröder, Janosch Cravillon, Michael Wiebcke,
    and Klaus Huber. “In Situ Static and Dynamic Light Scattering and Scanning Electron
    Microscopy Study on the Crystallization of the Dense Zinc Imidazolate Framework
    ZIF-Zni.” <i>Phys. Chem. Chem. Phys.</i> 14, no. 2 (2011): 511–21. <a href="https://doi.org/10.1039/c1cp22855b">https://doi.org/10.1039/c1cp22855b</a>.'
  ieee: 'T. Hikov, C. A. Schröder, J. Cravillon, M. Wiebcke, and K. Huber, “In situ
    static and dynamic light scattering and scanning electron microscopy study on
    the crystallization of the dense zinc imidazolate framework ZIF-zni,” <i>Phys.
    Chem. Chem. Phys.</i>, vol. 14, no. 2, pp. 511–521, 2011, doi: <a href="https://doi.org/10.1039/c1cp22855b">10.1039/c1cp22855b</a>.'
  mla: Hikov, Todor, et al. “In Situ Static and Dynamic Light Scattering and Scanning
    Electron Microscopy Study on the Crystallization of the Dense Zinc Imidazolate
    Framework ZIF-Zni.” <i>Phys. Chem. Chem. Phys.</i>, vol. 14, no. 2, Royal Society
    of Chemistry (RSC), 2011, pp. 511–21, doi:<a href="https://doi.org/10.1039/c1cp22855b">10.1039/c1cp22855b</a>.
  short: T. Hikov, C.A. Schröder, J. Cravillon, M. Wiebcke, K. Huber, Phys. Chem.
    Chem. Phys. 14 (2011) 511–521.
date_created: 2023-02-10T14:28:14Z
date_updated: 2023-02-10T14:28:40Z
department:
- _id: '314'
doi: 10.1039/c1cp22855b
intvolume: '        14'
issue: '2'
keyword:
- Physical and Theoretical Chemistry
- General Physics and Astronomy
language:
- iso: eng
page: 511-521
publication: Phys. Chem. Chem. Phys.
publication_identifier:
  issn:
  - 1463-9076
  - 1463-9084
publication_status: published
publisher: Royal Society of Chemistry (RSC)
status: public
title: In situ static and dynamic light scattering and scanning electron microscopy
  study on the crystallization of the dense zinc imidazolate framework ZIF-zni
type: journal_article
user_id: '237'
volume: 14
year: '2011'
...
---
_id: '41991'
article_number: '12959'
author:
- first_name: Christian
  full_name: Kunze, Christian
  last_name: Kunze
- first_name: Markus
  full_name: Valtiner, Markus
  last_name: Valtiner
- first_name: Rolf
  full_name: Michels, Rolf
  last_name: Michels
- first_name: Klaus
  full_name: Huber, Klaus
  id: '237'
  last_name: Huber
- first_name: Guido
  full_name: Grundmeier, Guido
  last_name: Grundmeier
citation:
  ama: Kunze C, Valtiner M, Michels R, Huber K, Grundmeier G. Self-localization of
    polyacrylic acid molecules on polar ZnO(0001)–Zn surfaces. <i>Physical Chemistry
    Chemical Physics</i>. 2011;13(28). doi:<a href="https://doi.org/10.1039/c1cp20913b">10.1039/c1cp20913b</a>
  apa: Kunze, C., Valtiner, M., Michels, R., Huber, K., &#38; Grundmeier, G. (2011).
    Self-localization of polyacrylic acid molecules on polar ZnO(0001)–Zn surfaces.
    <i>Physical Chemistry Chemical Physics</i>, <i>13</i>(28), Article 12959. <a href="https://doi.org/10.1039/c1cp20913b">https://doi.org/10.1039/c1cp20913b</a>
  bibtex: '@article{Kunze_Valtiner_Michels_Huber_Grundmeier_2011, title={Self-localization
    of polyacrylic acid molecules on polar ZnO(0001)–Zn surfaces}, volume={13}, DOI={<a
    href="https://doi.org/10.1039/c1cp20913b">10.1039/c1cp20913b</a>}, number={2812959},
    journal={Physical Chemistry Chemical Physics}, publisher={Royal Society of Chemistry
    (RSC)}, author={Kunze, Christian and Valtiner, Markus and Michels, Rolf and Huber,
    Klaus and Grundmeier, Guido}, year={2011} }'
  chicago: Kunze, Christian, Markus Valtiner, Rolf Michels, Klaus Huber, and Guido
    Grundmeier. “Self-Localization of Polyacrylic Acid Molecules on Polar ZnO(0001)–Zn
    Surfaces.” <i>Physical Chemistry Chemical Physics</i> 13, no. 28 (2011). <a href="https://doi.org/10.1039/c1cp20913b">https://doi.org/10.1039/c1cp20913b</a>.
  ieee: 'C. Kunze, M. Valtiner, R. Michels, K. Huber, and G. Grundmeier, “Self-localization
    of polyacrylic acid molecules on polar ZnO(0001)–Zn surfaces,” <i>Physical Chemistry
    Chemical Physics</i>, vol. 13, no. 28, Art. no. 12959, 2011, doi: <a href="https://doi.org/10.1039/c1cp20913b">10.1039/c1cp20913b</a>.'
  mla: Kunze, Christian, et al. “Self-Localization of Polyacrylic Acid Molecules on
    Polar ZnO(0001)–Zn Surfaces.” <i>Physical Chemistry Chemical Physics</i>, vol.
    13, no. 28, 12959, Royal Society of Chemistry (RSC), 2011, doi:<a href="https://doi.org/10.1039/c1cp20913b">10.1039/c1cp20913b</a>.
  short: C. Kunze, M. Valtiner, R. Michels, K. Huber, G. Grundmeier, Physical Chemistry
    Chemical Physics 13 (2011).
date_created: 2023-02-10T14:32:04Z
date_updated: 2023-02-10T14:32:27Z
department:
- _id: '314'
doi: 10.1039/c1cp20913b
intvolume: '        13'
issue: '28'
keyword:
- Physical and Theoretical Chemistry
- General Physics and Astronomy
language:
- iso: eng
publication: Physical Chemistry Chemical Physics
publication_identifier:
  issn:
  - 1463-9076
  - 1463-9084
publication_status: published
publisher: Royal Society of Chemistry (RSC)
status: public
title: Self-localization of polyacrylic acid molecules on polar ZnO(0001)–Zn surfaces
type: journal_article
user_id: '237'
volume: 13
year: '2011'
...
---
_id: '41266'
article_number: '5575'
author:
- first_name: Matthias
  full_name: Bauer, Matthias
  id: '47241'
  last_name: Bauer
  orcid: 0000-0002-9294-6076
- first_name: Christoph
  full_name: Gastl, Christoph
  last_name: Gastl
citation:
  ama: 'Bauer M, Gastl C. X-Ray absorption in homogeneous catalysis research: the
    iron-catalyzed Michael addition reaction by XAS, RIXS and multi-dimensional spectroscopy.
    <i>Physical Chemistry Chemical Physics</i>. 2010;12(21). doi:<a href="https://doi.org/10.1039/b926385c">10.1039/b926385c</a>'
  apa: 'Bauer, M., &#38; Gastl, C. (2010). X-Ray absorption in homogeneous catalysis
    research: the iron-catalyzed Michael addition reaction by XAS, RIXS and multi-dimensional
    spectroscopy. <i>Physical Chemistry Chemical Physics</i>, <i>12</i>(21), Article
    5575. <a href="https://doi.org/10.1039/b926385c">https://doi.org/10.1039/b926385c</a>'
  bibtex: '@article{Bauer_Gastl_2010, title={X-Ray absorption in homogeneous catalysis
    research: the iron-catalyzed Michael addition reaction by XAS, RIXS and multi-dimensional
    spectroscopy}, volume={12}, DOI={<a href="https://doi.org/10.1039/b926385c">10.1039/b926385c</a>},
    number={215575}, journal={Physical Chemistry Chemical Physics}, publisher={Royal
    Society of Chemistry (RSC)}, author={Bauer, Matthias and Gastl, Christoph}, year={2010}
    }'
  chicago: 'Bauer, Matthias, and Christoph Gastl. “X-Ray Absorption in Homogeneous
    Catalysis Research: The Iron-Catalyzed Michael Addition Reaction by XAS, RIXS
    and Multi-Dimensional Spectroscopy.” <i>Physical Chemistry Chemical Physics</i>
    12, no. 21 (2010). <a href="https://doi.org/10.1039/b926385c">https://doi.org/10.1039/b926385c</a>.'
  ieee: 'M. Bauer and C. Gastl, “X-Ray absorption in homogeneous catalysis research:
    the iron-catalyzed Michael addition reaction by XAS, RIXS and multi-dimensional
    spectroscopy,” <i>Physical Chemistry Chemical Physics</i>, vol. 12, no. 21, Art.
    no. 5575, 2010, doi: <a href="https://doi.org/10.1039/b926385c">10.1039/b926385c</a>.'
  mla: 'Bauer, Matthias, and Christoph Gastl. “X-Ray Absorption in Homogeneous Catalysis
    Research: The Iron-Catalyzed Michael Addition Reaction by XAS, RIXS and Multi-Dimensional
    Spectroscopy.” <i>Physical Chemistry Chemical Physics</i>, vol. 12, no. 21, 5575,
    Royal Society of Chemistry (RSC), 2010, doi:<a href="https://doi.org/10.1039/b926385c">10.1039/b926385c</a>.'
  short: M. Bauer, C. Gastl, Physical Chemistry Chemical Physics 12 (2010).
date_created: 2023-01-31T15:04:15Z
date_updated: 2023-01-31T15:04:22Z
department:
- _id: '306'
doi: 10.1039/b926385c
intvolume: '        12'
issue: '21'
keyword:
- Physical and Theoretical Chemistry
- General Physics and Astronomy
language:
- iso: eng
publication: Physical Chemistry Chemical Physics
publication_identifier:
  issn:
  - 1463-9076
  - 1463-9084
publication_status: published
publisher: Royal Society of Chemistry (RSC)
status: public
title: 'X-Ray absorption in homogeneous catalysis research: the iron-catalyzed Michael
  addition reaction by XAS, RIXS and multi-dimensional spectroscopy'
type: journal_article
user_id: '48467'
volume: 12
year: '2010'
...
---
_id: '41264'
article_number: '6520'
author:
- first_name: Augusta Bianca
  full_name: Ene, Augusta Bianca
  last_name: Ene
- first_name: Matthias
  full_name: Bauer, Matthias
  id: '47241'
  last_name: Bauer
  orcid: 0000-0002-9294-6076
- first_name: Tanja
  full_name: Archipov, Tanja
  last_name: Archipov
- first_name: Emil
  full_name: Roduner, Emil
  last_name: Roduner
citation:
  ama: Ene AB, Bauer M, Archipov T, Roduner E. Adsorption of oxygen on copper in Cu/HZSM5
    zeolites. <i>Physical Chemistry Chemical Physics</i>. 2010;12(24). doi:<a href="https://doi.org/10.1039/c000750a">10.1039/c000750a</a>
  apa: Ene, A. B., Bauer, M., Archipov, T., &#38; Roduner, E. (2010). Adsorption of
    oxygen on copper in Cu/HZSM5 zeolites. <i>Physical Chemistry Chemical Physics</i>,
    <i>12</i>(24), Article 6520. <a href="https://doi.org/10.1039/c000750a">https://doi.org/10.1039/c000750a</a>
  bibtex: '@article{Ene_Bauer_Archipov_Roduner_2010, title={Adsorption of oxygen on
    copper in Cu/HZSM5 zeolites}, volume={12}, DOI={<a href="https://doi.org/10.1039/c000750a">10.1039/c000750a</a>},
    number={246520}, journal={Physical Chemistry Chemical Physics}, publisher={Royal
    Society of Chemistry (RSC)}, author={Ene, Augusta Bianca and Bauer, Matthias and
    Archipov, Tanja and Roduner, Emil}, year={2010} }'
  chicago: Ene, Augusta Bianca, Matthias Bauer, Tanja Archipov, and Emil Roduner.
    “Adsorption of Oxygen on Copper in Cu/HZSM5 Zeolites.” <i>Physical Chemistry Chemical
    Physics</i> 12, no. 24 (2010). <a href="https://doi.org/10.1039/c000750a">https://doi.org/10.1039/c000750a</a>.
  ieee: 'A. B. Ene, M. Bauer, T. Archipov, and E. Roduner, “Adsorption of oxygen on
    copper in Cu/HZSM5 zeolites,” <i>Physical Chemistry Chemical Physics</i>, vol.
    12, no. 24, Art. no. 6520, 2010, doi: <a href="https://doi.org/10.1039/c000750a">10.1039/c000750a</a>.'
  mla: Ene, Augusta Bianca, et al. “Adsorption of Oxygen on Copper in Cu/HZSM5 Zeolites.”
    <i>Physical Chemistry Chemical Physics</i>, vol. 12, no. 24, 6520, Royal Society
    of Chemistry (RSC), 2010, doi:<a href="https://doi.org/10.1039/c000750a">10.1039/c000750a</a>.
  short: A.B. Ene, M. Bauer, T. Archipov, E. Roduner, Physical Chemistry Chemical
    Physics 12 (2010).
date_created: 2023-01-31T15:03:36Z
date_updated: 2023-01-31T15:03:45Z
department:
- _id: '306'
doi: 10.1039/c000750a
intvolume: '        12'
issue: '24'
keyword:
- Physical and Theoretical Chemistry
- General Physics and Astronomy
language:
- iso: eng
publication: Physical Chemistry Chemical Physics
publication_identifier:
  issn:
  - 1463-9076
  - 1463-9084
publication_status: published
publisher: Royal Society of Chemistry (RSC)
status: public
title: Adsorption of oxygen on copper in Cu/HZSM5 zeolites
type: journal_article
user_id: '48467'
volume: 12
year: '2010'
...
---
_id: '41278'
article_number: '2952'
author:
- first_name: Yasar
  full_name: Akdogan, Yasar
  last_name: Akdogan
- first_name: Christina
  full_name: Vogt, Christina
  last_name: Vogt
- first_name: Matthias
  full_name: Bauer, Matthias
  id: '47241'
  last_name: Bauer
  orcid: 0000-0002-9294-6076
- first_name: Helmut
  full_name: Bertagnolli, Helmut
  last_name: Bertagnolli
- first_name: Liviu
  full_name: Giurgiu, Liviu
  last_name: Giurgiu
- first_name: Emil
  full_name: Roduner, Emil
  last_name: Roduner
citation:
  ama: Akdogan Y, Vogt C, Bauer M, Bertagnolli H, Giurgiu L, Roduner E. Platinum species
    in the pores of NaX, NaY and NaA zeolites studied using EPR, XAS and FTIR spectroscopies.
    <i>Physical Chemistry Chemical Physics</i>. 2008;10(20). doi:<a href="https://doi.org/10.1039/b718932j">10.1039/b718932j</a>
  apa: Akdogan, Y., Vogt, C., Bauer, M., Bertagnolli, H., Giurgiu, L., &#38; Roduner,
    E. (2008). Platinum species in the pores of NaX, NaY and NaA zeolites studied
    using EPR, XAS and FTIR spectroscopies. <i>Physical Chemistry Chemical Physics</i>,
    <i>10</i>(20), Article 2952. <a href="https://doi.org/10.1039/b718932j">https://doi.org/10.1039/b718932j</a>
  bibtex: '@article{Akdogan_Vogt_Bauer_Bertagnolli_Giurgiu_Roduner_2008, title={Platinum
    species in the pores of NaX, NaY and NaA zeolites studied using EPR, XAS and FTIR
    spectroscopies}, volume={10}, DOI={<a href="https://doi.org/10.1039/b718932j">10.1039/b718932j</a>},
    number={202952}, journal={Physical Chemistry Chemical Physics}, publisher={Royal
    Society of Chemistry (RSC)}, author={Akdogan, Yasar and Vogt, Christina and Bauer,
    Matthias and Bertagnolli, Helmut and Giurgiu, Liviu and Roduner, Emil}, year={2008}
    }'
  chicago: Akdogan, Yasar, Christina Vogt, Matthias Bauer, Helmut Bertagnolli, Liviu
    Giurgiu, and Emil Roduner. “Platinum Species in the Pores of NaX, NaY and NaA
    Zeolites Studied Using EPR, XAS and FTIR Spectroscopies.” <i>Physical Chemistry
    Chemical Physics</i> 10, no. 20 (2008). <a href="https://doi.org/10.1039/b718932j">https://doi.org/10.1039/b718932j</a>.
  ieee: 'Y. Akdogan, C. Vogt, M. Bauer, H. Bertagnolli, L. Giurgiu, and E. Roduner,
    “Platinum species in the pores of NaX, NaY and NaA zeolites studied using EPR,
    XAS and FTIR spectroscopies,” <i>Physical Chemistry Chemical Physics</i>, vol.
    10, no. 20, Art. no. 2952, 2008, doi: <a href="https://doi.org/10.1039/b718932j">10.1039/b718932j</a>.'
  mla: Akdogan, Yasar, et al. “Platinum Species in the Pores of NaX, NaY and NaA Zeolites
    Studied Using EPR, XAS and FTIR Spectroscopies.” <i>Physical Chemistry Chemical
    Physics</i>, vol. 10, no. 20, 2952, Royal Society of Chemistry (RSC), 2008, doi:<a
    href="https://doi.org/10.1039/b718932j">10.1039/b718932j</a>.
  short: Y. Akdogan, C. Vogt, M. Bauer, H. Bertagnolli, L. Giurgiu, E. Roduner, Physical
    Chemistry Chemical Physics 10 (2008).
date_created: 2023-01-31T15:08:27Z
date_updated: 2023-01-31T15:08:36Z
department:
- _id: '306'
doi: 10.1039/b718932j
intvolume: '        10'
issue: '20'
keyword:
- Physical and Theoretical Chemistry
- General Physics and Astronomy
language:
- iso: eng
publication: Physical Chemistry Chemical Physics
publication_identifier:
  issn:
  - 1463-9076
  - 1463-9084
publication_status: published
publisher: Royal Society of Chemistry (RSC)
status: public
title: Platinum species in the pores of NaX, NaY and NaA zeolites studied using EPR,
  XAS and FTIR spectroscopies
type: journal_article
user_id: '48467'
volume: 10
year: '2008'
...
---
_id: '41287'
article_number: '2664'
author:
- first_name: Matthias
  full_name: Bauer, Matthias
  id: '47241'
  last_name: Bauer
  orcid: 0000-0002-9294-6076
- first_name: Thomas
  full_name: Kauf, Thomas
  last_name: Kauf
- first_name: Jens
  full_name: Christoffers, Jens
  last_name: Christoffers
- first_name: Helmut
  full_name: Bertagnolli, Helmut
  last_name: Bertagnolli
citation:
  ama: Bauer M, Kauf T, Christoffers J, Bertagnolli H. Investigations into the metal
    species of the homogeneous iron(iii) catalyzed Michael addition reactions. <i>Physical
    Chemistry Chemical Physics</i>. 2005;7(13). doi:<a href="https://doi.org/10.1039/b501204j">10.1039/b501204j</a>
  apa: Bauer, M., Kauf, T., Christoffers, J., &#38; Bertagnolli, H. (2005). Investigations
    into the metal species of the homogeneous iron(iii) catalyzed Michael addition
    reactions. <i>Physical Chemistry Chemical Physics</i>, <i>7</i>(13), Article 2664.
    <a href="https://doi.org/10.1039/b501204j">https://doi.org/10.1039/b501204j</a>
  bibtex: '@article{Bauer_Kauf_Christoffers_Bertagnolli_2005, title={Investigations
    into the metal species of the homogeneous iron(iii) catalyzed Michael addition
    reactions}, volume={7}, DOI={<a href="https://doi.org/10.1039/b501204j">10.1039/b501204j</a>},
    number={132664}, journal={Physical Chemistry Chemical Physics}, publisher={Royal
    Society of Chemistry (RSC)}, author={Bauer, Matthias and Kauf, Thomas and Christoffers,
    Jens and Bertagnolli, Helmut}, year={2005} }'
  chicago: Bauer, Matthias, Thomas Kauf, Jens Christoffers, and Helmut Bertagnolli.
    “Investigations into the Metal Species of the Homogeneous Iron(Iii) Catalyzed
    Michael Addition Reactions.” <i>Physical Chemistry Chemical Physics</i> 7, no.
    13 (2005). <a href="https://doi.org/10.1039/b501204j">https://doi.org/10.1039/b501204j</a>.
  ieee: 'M. Bauer, T. Kauf, J. Christoffers, and H. Bertagnolli, “Investigations into
    the metal species of the homogeneous iron(iii) catalyzed Michael addition reactions,”
    <i>Physical Chemistry Chemical Physics</i>, vol. 7, no. 13, Art. no. 2664, 2005,
    doi: <a href="https://doi.org/10.1039/b501204j">10.1039/b501204j</a>.'
  mla: Bauer, Matthias, et al. “Investigations into the Metal Species of the Homogeneous
    Iron(Iii) Catalyzed Michael Addition Reactions.” <i>Physical Chemistry Chemical
    Physics</i>, vol. 7, no. 13, 2664, Royal Society of Chemistry (RSC), 2005, doi:<a
    href="https://doi.org/10.1039/b501204j">10.1039/b501204j</a>.
  short: M. Bauer, T. Kauf, J. Christoffers, H. Bertagnolli, Physical Chemistry Chemical
    Physics 7 (2005).
date_created: 2023-01-31T15:11:26Z
date_updated: 2023-01-31T15:11:33Z
department:
- _id: '306'
doi: 10.1039/b501204j
intvolume: '         7'
issue: '13'
keyword:
- Physical and Theoretical Chemistry
- General Physics and Astronomy
language:
- iso: eng
publication: Physical Chemistry Chemical Physics
publication_identifier:
  issn:
  - 1463-9076
  - 1463-9084
publication_status: published
publisher: Royal Society of Chemistry (RSC)
status: public
title: Investigations into the metal species of the homogeneous iron(iii) catalyzed
  Michael addition reactions
type: journal_article
user_id: '48467'
volume: 7
year: '2005'
...
---
_id: '42040'
author:
- first_name: Bernd
  full_name: Neumann, Bernd
  last_name: Neumann
- first_name: Klaus
  full_name: Huber, Klaus
  id: '237'
  last_name: Huber
- first_name: Peter
  full_name: Pollmann, Peter
  last_name: Pollmann
citation:
  ama: Neumann B, Huber K, Pollmann P. A comparative experimental study of the aggregation
    of Acid Red 266 in aqueous solution by use of 19F-NMR, UV/Vis spectroscopy and
    static light scattering. <i>Physical Chemistry Chemical Physics</i>. 2002;2(16):3687-3695.
    doi:<a href="https://doi.org/10.1039/b004172f">10.1039/b004172f</a>
  apa: Neumann, B., Huber, K., &#38; Pollmann, P. (2002). A comparative experimental
    study of the aggregation of Acid Red 266 in aqueous solution by use of 19F-NMR,
    UV/Vis spectroscopy and static light scattering. <i>Physical Chemistry Chemical
    Physics</i>, <i>2</i>(16), 3687–3695. <a href="https://doi.org/10.1039/b004172f">https://doi.org/10.1039/b004172f</a>
  bibtex: '@article{Neumann_Huber_Pollmann_2002, title={A comparative experimental
    study of the aggregation of Acid Red 266 in aqueous solution by use of 19F-NMR,
    UV/Vis spectroscopy and static light scattering}, volume={2}, DOI={<a href="https://doi.org/10.1039/b004172f">10.1039/b004172f</a>},
    number={16}, journal={Physical Chemistry Chemical Physics}, publisher={Royal Society
    of Chemistry (RSC)}, author={Neumann, Bernd and Huber, Klaus and Pollmann, Peter},
    year={2002}, pages={3687–3695} }'
  chicago: 'Neumann, Bernd, Klaus Huber, and Peter Pollmann. “A Comparative Experimental
    Study of the Aggregation of Acid Red 266 in Aqueous Solution by Use of 19F-NMR,
    UV/Vis Spectroscopy and Static Light Scattering.” <i>Physical Chemistry Chemical
    Physics</i> 2, no. 16 (2002): 3687–95. <a href="https://doi.org/10.1039/b004172f">https://doi.org/10.1039/b004172f</a>.'
  ieee: 'B. Neumann, K. Huber, and P. Pollmann, “A comparative experimental study
    of the aggregation of Acid Red 266 in aqueous solution by use of 19F-NMR, UV/Vis
    spectroscopy and static light scattering,” <i>Physical Chemistry Chemical Physics</i>,
    vol. 2, no. 16, pp. 3687–3695, 2002, doi: <a href="https://doi.org/10.1039/b004172f">10.1039/b004172f</a>.'
  mla: Neumann, Bernd, et al. “A Comparative Experimental Study of the Aggregation
    of Acid Red 266 in Aqueous Solution by Use of 19F-NMR, UV/Vis Spectroscopy and
    Static Light Scattering.” <i>Physical Chemistry Chemical Physics</i>, vol. 2,
    no. 16, Royal Society of Chemistry (RSC), 2002, pp. 3687–95, doi:<a href="https://doi.org/10.1039/b004172f">10.1039/b004172f</a>.
  short: B. Neumann, K. Huber, P. Pollmann, Physical Chemistry Chemical Physics 2
    (2002) 3687–3695.
date_created: 2023-02-13T09:10:00Z
date_updated: 2023-02-13T09:10:23Z
department:
- _id: '314'
doi: 10.1039/b004172f
intvolume: '         2'
issue: '16'
keyword:
- Physical and Theoretical Chemistry
- General Physics and Astronomy
language:
- iso: eng
page: 3687-3695
publication: Physical Chemistry Chemical Physics
publication_identifier:
  issn:
  - 1463-9076
  - 1463-9084
publication_status: published
publisher: Royal Society of Chemistry (RSC)
status: public
title: A comparative experimental study of the aggregation of Acid Red 266 in aqueous
  solution by use of 19F-NMR, UV/Vis spectroscopy and static light scattering
type: journal_article
user_id: '237'
volume: 2
year: '2002'
...
