---
_id: '41008'
author:
- first_name: Philipp
  full_name: Dierks, Philipp
  last_name: Dierks
citation:
  ama: Dierks P. <i>Synthesis and Characterization of Multichromophoric Iron(II) Complexes
    as Novel Photosensitizers</i>.; 2022. doi:<a href="https://doi.org/10.17619/UNIPB/1-1558">10.17619/UNIPB/1-1558</a>
  apa: Dierks, P. (2022). <i>Synthesis and characterization of multichromophoric iron(II)
    complexes as novel photosensitizers</i>. <a href="https://doi.org/10.17619/UNIPB/1-1558">https://doi.org/10.17619/UNIPB/1-1558</a>
  bibtex: '@book{Dierks_2022, title={Synthesis and characterization of multichromophoric
    iron(II) complexes as novel photosensitizers}, DOI={<a href="https://doi.org/10.17619/UNIPB/1-1558">10.17619/UNIPB/1-1558</a>},
    author={Dierks, Philipp}, year={2022} }'
  chicago: Dierks, Philipp. <i>Synthesis and Characterization of Multichromophoric
    Iron(II) Complexes as Novel Photosensitizers</i>, 2022. <a href="https://doi.org/10.17619/UNIPB/1-1558">https://doi.org/10.17619/UNIPB/1-1558</a>.
  ieee: P. Dierks, <i>Synthesis and characterization of multichromophoric iron(II)
    complexes as novel photosensitizers</i>. 2022.
  mla: Dierks, Philipp. <i>Synthesis and Characterization of Multichromophoric Iron(II)
    Complexes as Novel Photosensitizers</i>. 2022, doi:<a href="https://doi.org/10.17619/UNIPB/1-1558">10.17619/UNIPB/1-1558</a>.
  short: P. Dierks, Synthesis and Characterization of Multichromophoric Iron(II) Complexes
    as Novel Photosensitizers, 2022.
date_created: 2023-01-30T17:01:36Z
date_updated: 2023-01-31T08:19:20Z
department:
- _id: '35'
- _id: '306'
doi: 10.17619/UNIPB/1-1558
language:
- iso: eng
status: public
supervisor:
- first_name: Matthias
  full_name: Bauer, Matthias
  id: '47241'
  last_name: Bauer
  orcid: 0000-0002-9294-6076
title: Synthesis and characterization of multichromophoric iron(II) complexes as novel
  photosensitizers
type: dissertation
user_id: '27611'
year: '2022'
...
---
_id: '41014'
author:
- first_name: Marina
  full_name: Huber-Gedert, Marina
  last_name: Huber-Gedert
citation:
  ama: Huber-Gedert M. <i>Base Metal Iron(II)-Cobalt(III) Dyads for Photocatalytic
    Hydrogen Evolution</i>.; 2022.
  apa: Huber-Gedert, M. (2022). <i>Base Metal Iron(II)-Cobalt(III) Dyads for Photocatalytic
    Hydrogen Evolution</i>.
  bibtex: '@book{Huber-Gedert_2022, title={Base Metal Iron(II)-Cobalt(III) Dyads for
    Photocatalytic Hydrogen Evolution}, author={Huber-Gedert, Marina}, year={2022}
    }'
  chicago: Huber-Gedert, Marina. <i>Base Metal Iron(II)-Cobalt(III) Dyads for Photocatalytic
    Hydrogen Evolution</i>, 2022.
  ieee: M. Huber-Gedert, <i>Base Metal Iron(II)-Cobalt(III) Dyads for Photocatalytic
    Hydrogen Evolution</i>. 2022.
  mla: Huber-Gedert, Marina. <i>Base Metal Iron(II)-Cobalt(III) Dyads for Photocatalytic
    Hydrogen Evolution</i>. 2022.
  short: M. Huber-Gedert, Base Metal Iron(II)-Cobalt(III) Dyads for Photocatalytic
    Hydrogen Evolution, 2022.
date_created: 2023-01-30T17:02:51Z
date_updated: 2023-01-31T08:19:30Z
department:
- _id: '35'
- _id: '306'
language:
- iso: eng
status: public
supervisor:
- first_name: Matthias
  full_name: Bauer, Matthias
  id: '47241'
  last_name: Bauer
  orcid: 0000-0002-9294-6076
title: Base Metal Iron(II)-Cobalt(III) Dyads for Photocatalytic Hydrogen Evolution
type: dissertation
user_id: '27611'
year: '2022'
...
---
_id: '36425'
article_number: '106977'
author:
- first_name: Deniz
  full_name: Dogan, Deniz
  last_name: Dogan
- first_name: Simon
  full_name: Ruthmann, Simon
  last_name: Ruthmann
- first_name: Oliver
  full_name: Seewald, Oliver
  last_name: Seewald
- first_name: Wolfgang
  full_name: Bremser, Wolfgang
  last_name: Bremser
citation:
  ama: Dogan D, Ruthmann S, Seewald O, Bremser W. Tuning of antifouling active PDMS
    domains tethered to epoxy/amine surface. <i>Progress in Organic Coatings</i>.
    2022;170. doi:<a href="https://doi.org/10.1016/j.porgcoat.2022.106977">10.1016/j.porgcoat.2022.106977</a>
  apa: Dogan, D., Ruthmann, S., Seewald, O., &#38; Bremser, W. (2022). Tuning of antifouling
    active PDMS domains tethered to epoxy/amine surface. <i>Progress in Organic Coatings</i>,
    <i>170</i>, Article 106977. <a href="https://doi.org/10.1016/j.porgcoat.2022.106977">https://doi.org/10.1016/j.porgcoat.2022.106977</a>
  bibtex: '@article{Dogan_Ruthmann_Seewald_Bremser_2022, title={Tuning of antifouling
    active PDMS domains tethered to epoxy/amine surface}, volume={170}, DOI={<a href="https://doi.org/10.1016/j.porgcoat.2022.106977">10.1016/j.porgcoat.2022.106977</a>},
    number={106977}, journal={Progress in Organic Coatings}, publisher={Elsevier BV},
    author={Dogan, Deniz and Ruthmann, Simon and Seewald, Oliver and Bremser, Wolfgang},
    year={2022} }'
  chicago: Dogan, Deniz, Simon Ruthmann, Oliver Seewald, and Wolfgang Bremser. “Tuning
    of Antifouling Active PDMS Domains Tethered to Epoxy/Amine Surface.” <i>Progress
    in Organic Coatings</i> 170 (2022). <a href="https://doi.org/10.1016/j.porgcoat.2022.106977">https://doi.org/10.1016/j.porgcoat.2022.106977</a>.
  ieee: 'D. Dogan, S. Ruthmann, O. Seewald, and W. Bremser, “Tuning of antifouling
    active PDMS domains tethered to epoxy/amine surface,” <i>Progress in Organic Coatings</i>,
    vol. 170, Art. no. 106977, 2022, doi: <a href="https://doi.org/10.1016/j.porgcoat.2022.106977">10.1016/j.porgcoat.2022.106977</a>.'
  mla: Dogan, Deniz, et al. “Tuning of Antifouling Active PDMS Domains Tethered to
    Epoxy/Amine Surface.” <i>Progress in Organic Coatings</i>, vol. 170, 106977, Elsevier
    BV, 2022, doi:<a href="https://doi.org/10.1016/j.porgcoat.2022.106977">10.1016/j.porgcoat.2022.106977</a>.
  short: D. Dogan, S. Ruthmann, O. Seewald, W. Bremser, Progress in Organic Coatings
    170 (2022).
date_created: 2023-01-12T12:45:39Z
date_updated: 2023-02-06T09:58:55Z
department:
- _id: '35'
- _id: '301'
- _id: '321'
doi: 10.1016/j.porgcoat.2022.106977
intvolume: '       170'
keyword:
- Materials Chemistry
- Organic Chemistry
- Surfaces
- Coatings and Films
- General Chemical Engineering
language:
- iso: eng
publication: Progress in Organic Coatings
publication_identifier:
  issn:
  - 0300-9440
publication_status: published
publisher: Elsevier BV
status: public
title: Tuning of antifouling active PDMS domains tethered to epoxy/amine surface
type: journal_article
user_id: '32'
volume: 170
year: '2022'
...
---
_id: '41810'
abstract:
- lang: eng
  text: <jats:p>Furfuryl amine-functionalized few-layered graphene was prepared <jats:italic>via</jats:italic>
    a mechanochemical process by a [4 + 2] cycloaddition under solvent-free conditions.</jats:p>
author:
- first_name: Najmeh Filvan
  full_name: Torkaman, Najmeh Filvan
  last_name: Torkaman
- first_name: Marina
  full_name: Kley, Marina
  last_name: Kley
- first_name: Wolfgang
  full_name: Bremser, Wolfgang
  last_name: Bremser
- first_name: René
  full_name: Wilhelm, René
  last_name: Wilhelm
citation:
  ama: Torkaman NF, Kley M, Bremser W, Wilhelm R. Reversible functionalization and
    exfoliation of graphite by a Diels–Alder reaction with furfuryl amine. <i>RSC
    Advances</i>. 2022;12(27):17249-17256. doi:<a href="https://doi.org/10.1039/d2ra02566c">10.1039/d2ra02566c</a>
  apa: Torkaman, N. F., Kley, M., Bremser, W., &#38; Wilhelm, R. (2022). Reversible
    functionalization and exfoliation of graphite by a Diels–Alder reaction with furfuryl
    amine. <i>RSC Advances</i>, <i>12</i>(27), 17249–17256. <a href="https://doi.org/10.1039/d2ra02566c">https://doi.org/10.1039/d2ra02566c</a>
  bibtex: '@article{Torkaman_Kley_Bremser_Wilhelm_2022, title={Reversible functionalization
    and exfoliation of graphite by a Diels–Alder reaction with furfuryl amine}, volume={12},
    DOI={<a href="https://doi.org/10.1039/d2ra02566c">10.1039/d2ra02566c</a>}, number={27},
    journal={RSC Advances}, publisher={Royal Society of Chemistry (RSC)}, author={Torkaman,
    Najmeh Filvan and Kley, Marina and Bremser, Wolfgang and Wilhelm, René}, year={2022},
    pages={17249–17256} }'
  chicago: 'Torkaman, Najmeh Filvan, Marina Kley, Wolfgang Bremser, and René Wilhelm.
    “Reversible Functionalization and Exfoliation of Graphite by a Diels–Alder Reaction
    with Furfuryl Amine.” <i>RSC Advances</i> 12, no. 27 (2022): 17249–56. <a href="https://doi.org/10.1039/d2ra02566c">https://doi.org/10.1039/d2ra02566c</a>.'
  ieee: 'N. F. Torkaman, M. Kley, W. Bremser, and R. Wilhelm, “Reversible functionalization
    and exfoliation of graphite by a Diels–Alder reaction with furfuryl amine,” <i>RSC
    Advances</i>, vol. 12, no. 27, pp. 17249–17256, 2022, doi: <a href="https://doi.org/10.1039/d2ra02566c">10.1039/d2ra02566c</a>.'
  mla: Torkaman, Najmeh Filvan, et al. “Reversible Functionalization and Exfoliation
    of Graphite by a Diels–Alder Reaction with Furfuryl Amine.” <i>RSC Advances</i>,
    vol. 12, no. 27, Royal Society of Chemistry (RSC), 2022, pp. 17249–56, doi:<a
    href="https://doi.org/10.1039/d2ra02566c">10.1039/d2ra02566c</a>.
  short: N.F. Torkaman, M. Kley, W. Bremser, R. Wilhelm, RSC Advances 12 (2022) 17249–17256.
date_created: 2023-02-06T10:30:40Z
date_updated: 2023-02-06T10:33:03Z
department:
- _id: '301'
- _id: '321'
doi: 10.1039/d2ra02566c
intvolume: '        12'
issue: '27'
keyword:
- General Chemical Engineering
- General Chemistry
language:
- iso: eng
page: 17249-17256
publication: RSC Advances
publication_identifier:
  issn:
  - 2046-2069
publication_status: published
publisher: Royal Society of Chemistry (RSC)
status: public
title: Reversible functionalization and exfoliation of graphite by a Diels–Alder reaction
  with furfuryl amine
type: journal_article
user_id: '32'
volume: 12
year: '2022'
...
---
_id: '41649'
author:
- first_name: Anne
  full_name: Büngeler, Anne
  last_name: Büngeler
- first_name: Fabian
  full_name: Kollmann, Fabian
  last_name: Kollmann
- first_name: Klaus
  full_name: Huber, Klaus
  id: '237'
  last_name: Huber
- first_name: Oliver I.
  full_name: Strube, Oliver I.
  last_name: Strube
citation:
  ama: Büngeler A, Kollmann F, Huber K, Strube OI. Targeted Synthesis of the Type-A
    Particle Substructure from Enzymatically Produced Eumelanin. <i>Biomacromolecules</i>.
    2022;23(3):1020-1029. doi:<a href="https://doi.org/10.1021/acs.biomac.1c01390">10.1021/acs.biomac.1c01390</a>
  apa: Büngeler, A., Kollmann, F., Huber, K., &#38; Strube, O. I. (2022). Targeted
    Synthesis of the Type-A Particle Substructure from Enzymatically Produced Eumelanin.
    <i>Biomacromolecules</i>, <i>23</i>(3), 1020–1029. <a href="https://doi.org/10.1021/acs.biomac.1c01390">https://doi.org/10.1021/acs.biomac.1c01390</a>
  bibtex: '@article{Büngeler_Kollmann_Huber_Strube_2022, title={Targeted Synthesis
    of the Type-A Particle Substructure from Enzymatically Produced Eumelanin}, volume={23},
    DOI={<a href="https://doi.org/10.1021/acs.biomac.1c01390">10.1021/acs.biomac.1c01390</a>},
    number={3}, journal={Biomacromolecules}, publisher={American Chemical Society
    (ACS)}, author={Büngeler, Anne and Kollmann, Fabian and Huber, Klaus and Strube,
    Oliver I.}, year={2022}, pages={1020–1029} }'
  chicago: 'Büngeler, Anne, Fabian Kollmann, Klaus Huber, and Oliver I. Strube. “Targeted
    Synthesis of the Type-A Particle Substructure from Enzymatically Produced Eumelanin.”
    <i>Biomacromolecules</i> 23, no. 3 (2022): 1020–29. <a href="https://doi.org/10.1021/acs.biomac.1c01390">https://doi.org/10.1021/acs.biomac.1c01390</a>.'
  ieee: 'A. Büngeler, F. Kollmann, K. Huber, and O. I. Strube, “Targeted Synthesis
    of the Type-A Particle Substructure from Enzymatically Produced Eumelanin,” <i>Biomacromolecules</i>,
    vol. 23, no. 3, pp. 1020–1029, 2022, doi: <a href="https://doi.org/10.1021/acs.biomac.1c01390">10.1021/acs.biomac.1c01390</a>.'
  mla: Büngeler, Anne, et al. “Targeted Synthesis of the Type-A Particle Substructure
    from Enzymatically Produced Eumelanin.” <i>Biomacromolecules</i>, vol. 23, no.
    3, American Chemical Society (ACS), 2022, pp. 1020–29, doi:<a href="https://doi.org/10.1021/acs.biomac.1c01390">10.1021/acs.biomac.1c01390</a>.
  short: A. Büngeler, F. Kollmann, K. Huber, O.I. Strube, Biomacromolecules 23 (2022)
    1020–1029.
date_created: 2023-02-03T15:03:13Z
date_updated: 2023-02-06T12:06:49Z
department:
- _id: '314'
doi: 10.1021/acs.biomac.1c01390
intvolume: '        23'
issue: '3'
keyword:
- Materials Chemistry
- Polymers and Plastics
- Biomaterials
- Bioengineering
language:
- iso: eng
page: 1020-1029
publication: Biomacromolecules
publication_identifier:
  issn:
  - 1525-7797
  - 1526-4602
publication_status: published
publisher: American Chemical Society (ACS)
status: public
title: Targeted Synthesis of the Type-A Particle Substructure from Enzymatically Produced
  Eumelanin
type: journal_article
user_id: '237'
volume: 23
year: '2022'
...
---
_id: '35707'
abstract:
- lang: eng
  text: <jats:p>The proton conductivity of two coordination networks, [Mg(H<jats:sub>2</jats:sub>O)<jats:sub>2</jats:sub>(H<jats:sub>3</jats:sub>L)]·H<jats:sub>2</jats:sub>O
    and [Pb<jats:sub>2</jats:sub>(HL)]·H<jats:sub>2</jats:sub>O (H<jats:sub>5</jats:sub>L
    = (H<jats:sub>2</jats:sub>O<jats:sub>3</jats:sub>PCH<jats:sub>2</jats:sub>)<jats:sub>2</jats:sub>-NCH<jats:sub>2</jats:sub>-C<jats:sub>6</jats:sub>H<jats:sub>4</jats:sub>-SO<jats:sub>3</jats:sub>H),
    is investigated by AC impedance spectroscopy. Both materials contain the same
    phosphonato-sulfonate linker molecule, but have clearly different crystal structures,
    which has a strong effect on proton conductivity. In the Mg-based coordination
    network, dangling sulfonate groups are part of an extended hydrogen bonding network,
    facilitating a “proton hopping” with low activation energy; the material shows
    a moderate proton conductivity. In the Pb-based metal-organic framework, in contrast,
    no extended hydrogen bonding occurs, as the sulfonate groups coordinate to Pb<jats:sup>2+</jats:sup>,
    without forming hydrogen bonds; the proton conductivity is much lower in this
    material.</jats:p>
article_type: original
author:
- first_name: Ali
  full_name: Javed, Ali
  last_name: Javed
- first_name: Felix
  full_name: Steinke, Felix
  last_name: Steinke
- first_name: Stephan
  full_name: Wöhlbrandt, Stephan
  last_name: Wöhlbrandt
- first_name: Hana
  full_name: Bunzen, Hana
  last_name: Bunzen
- 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
citation:
  ama: Javed A, Steinke F, Wöhlbrandt S, Bunzen H, Stock N, Tiemann M. The role of
    sulfonate groups and hydrogen bonding in the proton conductivity of two coordination
    networks. <i>Beilstein Journal of Nanotechnology</i>. 2022;13:437-443. doi:<a
    href="https://doi.org/10.3762/bjnano.13.36">10.3762/bjnano.13.36</a>
  apa: Javed, A., Steinke, F., Wöhlbrandt, S., Bunzen, H., Stock, N., &#38; Tiemann,
    M. (2022). The role of sulfonate groups and hydrogen bonding in the proton conductivity
    of two coordination networks. <i>Beilstein Journal of Nanotechnology</i>, <i>13</i>,
    437–443. <a href="https://doi.org/10.3762/bjnano.13.36">https://doi.org/10.3762/bjnano.13.36</a>
  bibtex: '@article{Javed_Steinke_Wöhlbrandt_Bunzen_Stock_Tiemann_2022, title={The
    role of sulfonate groups and hydrogen bonding in the proton conductivity of two
    coordination networks}, volume={13}, DOI={<a href="https://doi.org/10.3762/bjnano.13.36">10.3762/bjnano.13.36</a>},
    journal={Beilstein Journal of Nanotechnology}, publisher={Beilstein Institut},
    author={Javed, Ali and Steinke, Felix and Wöhlbrandt, Stephan and Bunzen, Hana
    and Stock, Norbert and Tiemann, Michael}, year={2022}, pages={437–443} }'
  chicago: 'Javed, Ali, Felix Steinke, Stephan Wöhlbrandt, Hana Bunzen, Norbert Stock,
    and Michael Tiemann. “The Role of Sulfonate Groups and Hydrogen Bonding in the
    Proton Conductivity of Two Coordination Networks.” <i>Beilstein Journal of Nanotechnology</i>
    13 (2022): 437–43. <a href="https://doi.org/10.3762/bjnano.13.36">https://doi.org/10.3762/bjnano.13.36</a>.'
  ieee: 'A. Javed, F. Steinke, S. Wöhlbrandt, H. Bunzen, N. Stock, and M. Tiemann,
    “The role of sulfonate groups and hydrogen bonding in the proton conductivity
    of two coordination networks,” <i>Beilstein Journal of Nanotechnology</i>, vol.
    13, pp. 437–443, 2022, doi: <a href="https://doi.org/10.3762/bjnano.13.36">10.3762/bjnano.13.36</a>.'
  mla: Javed, Ali, et al. “The Role of Sulfonate Groups and Hydrogen Bonding in the
    Proton Conductivity of Two Coordination Networks.” <i>Beilstein Journal of Nanotechnology</i>,
    vol. 13, Beilstein Institut, 2022, pp. 437–43, doi:<a href="https://doi.org/10.3762/bjnano.13.36">10.3762/bjnano.13.36</a>.
  short: A. Javed, F. Steinke, S. Wöhlbrandt, H. Bunzen, N. Stock, M. Tiemann, Beilstein
    Journal of Nanotechnology 13 (2022) 437–443.
date_created: 2023-01-10T09:12:54Z
date_updated: 2023-03-03T08:37:14Z
department:
- _id: '35'
- _id: '2'
- _id: '307'
doi: 10.3762/bjnano.13.36
intvolume: '        13'
keyword:
- Electrical and Electronic Engineering
- General Physics and Astronomy
- General Materials Science
language:
- iso: eng
main_file_link:
- open_access: '1'
  url: https://www.beilstein-journals.org/bjnano/content/pdf/2190-4286-13-36.pdf
oa: '1'
page: 437-443
publication: Beilstein Journal of Nanotechnology
publication_identifier:
  issn:
  - 2190-4286
publication_status: published
publisher: Beilstein Institut
quality_controlled: '1'
status: public
title: The role of sulfonate groups and hydrogen bonding in the proton conductivity
  of two coordination networks
type: journal_article
user_id: '23547'
volume: 13
year: '2022'
...
---
_id: '33691'
abstract:
- lang: eng
  text: Near ambient pressure XPS in nitrogen atmosphere was utilized to investigate
    gas-solid interactions within porous SiO2 films ranging from 30 to 75 nm thickness.
    The films were differentiated in terms of porosity and roughness. The XPS N1s
    core levels of the N2 gas in presence of the SiO2 samples showed variations in
    width, binding energy and line shape. The width correlated with the surface charge
    induced in the dielectric films upon X-ray irradiation. The observed different
    binding energies observed for the N1s peak can only partly be associated with
    intrinsic work function differences between the samples, opening the possibility
    that the effect of physisorption at room temperature could be detected by a shift
    in the measured binding energy. However, the signals also show an increasing asymmetry
    with rising surface charge. This might be associated with the formation of vertical
    electrical gradients within the dielectric porous thin films, which complicates
    the assignment of binding energy positions to specific surface-related effects.
    With the support of Monte Carlo and first principles density functional theory
    calculations, the observed shifts were discussed in terms of the possible formation
    of transitory dipoles upon N2 physisorption within the porous SiO2 films.
article_number: '154525'
article_type: original
author:
- first_name: Teresa
  full_name: de los Arcos, Teresa
  last_name: de los Arcos
- first_name: Christian
  full_name: Weinberger, Christian
  id: '11848'
  last_name: Weinberger
- first_name: Frederik
  full_name: Zysk, Frederik
  id: '14757'
  last_name: Zysk
- first_name: Varun
  full_name: Raj Damerla, Varun
  last_name: Raj Damerla
- first_name: Sabrina
  full_name: Kollmann, Sabrina
  last_name: Kollmann
- first_name: Pascal
  full_name: Vieth, Pascal
  last_name: Vieth
- first_name: Michael
  full_name: Tiemann, Michael
  id: '23547'
  last_name: Tiemann
  orcid: 0000-0003-1711-2722
- first_name: Thomas
  full_name: Kühne, Thomas
  id: '49079'
  last_name: Kühne
- first_name: Guido
  full_name: Grundmeier, Guido
  id: '194'
  last_name: Grundmeier
citation:
  ama: de los Arcos T, Weinberger C, Zysk F, et al. Challenges in the interpretation
    of gas core levels for the determination of gas-solid interactions within dielectric
    porous films by ambient pressure XPS. <i>Applied Surface Science</i>. 2022;604.
    doi:<a href="https://doi.org/10.1016/j.apsusc.2022.154525">10.1016/j.apsusc.2022.154525</a>
  apa: de los Arcos, T., Weinberger, C., Zysk, F., Raj Damerla, V., Kollmann, S.,
    Vieth, P., Tiemann, M., Kühne, T., &#38; Grundmeier, G. (2022). Challenges in
    the interpretation of gas core levels for the determination of gas-solid interactions
    within dielectric porous films by ambient pressure XPS. <i>Applied Surface Science</i>,
    <i>604</i>, Article 154525. <a href="https://doi.org/10.1016/j.apsusc.2022.154525">https://doi.org/10.1016/j.apsusc.2022.154525</a>
  bibtex: '@article{de los Arcos_Weinberger_Zysk_Raj Damerla_Kollmann_Vieth_Tiemann_Kühne_Grundmeier_2022,
    title={Challenges in the interpretation of gas core levels for the determination
    of gas-solid interactions within dielectric porous films by ambient pressure XPS},
    volume={604}, DOI={<a href="https://doi.org/10.1016/j.apsusc.2022.154525">10.1016/j.apsusc.2022.154525</a>},
    number={154525}, journal={Applied Surface Science}, publisher={Elsevier BV}, author={de
    los Arcos, Teresa and Weinberger, Christian and Zysk, Frederik and Raj Damerla,
    Varun and Kollmann, Sabrina and Vieth, Pascal and Tiemann, Michael and Kühne,
    Thomas and Grundmeier, Guido}, year={2022} }'
  chicago: Arcos, Teresa de los, Christian Weinberger, Frederik Zysk, Varun Raj Damerla,
    Sabrina Kollmann, Pascal Vieth, Michael Tiemann, Thomas Kühne, and Guido Grundmeier.
    “Challenges in the Interpretation of Gas Core Levels for the Determination of
    Gas-Solid Interactions within Dielectric Porous Films by Ambient Pressure XPS.”
    <i>Applied Surface Science</i> 604 (2022). <a href="https://doi.org/10.1016/j.apsusc.2022.154525">https://doi.org/10.1016/j.apsusc.2022.154525</a>.
  ieee: 'T. de los Arcos <i>et al.</i>, “Challenges in the interpretation of gas core
    levels for the determination of gas-solid interactions within dielectric porous
    films by ambient pressure XPS,” <i>Applied Surface Science</i>, vol. 604, Art.
    no. 154525, 2022, doi: <a href="https://doi.org/10.1016/j.apsusc.2022.154525">10.1016/j.apsusc.2022.154525</a>.'
  mla: de los Arcos, Teresa, et al. “Challenges in the Interpretation of Gas Core
    Levels for the Determination of Gas-Solid Interactions within Dielectric Porous
    Films by Ambient Pressure XPS.” <i>Applied Surface Science</i>, vol. 604, 154525,
    Elsevier BV, 2022, doi:<a href="https://doi.org/10.1016/j.apsusc.2022.154525">10.1016/j.apsusc.2022.154525</a>.
  short: T. de los Arcos, C. Weinberger, F. Zysk, V. Raj Damerla, S. Kollmann, P.
    Vieth, M. Tiemann, T. Kühne, G. Grundmeier, Applied Surface Science 604 (2022).
date_created: 2022-10-11T08:22:25Z
date_updated: 2023-03-03T11:32:04Z
department:
- _id: '613'
- _id: '35'
- _id: '2'
- _id: '307'
- _id: '302'
- _id: '304'
doi: 10.1016/j.apsusc.2022.154525
intvolume: '       604'
keyword:
- Surfaces
- Coatings and Films
- Condensed Matter Physics
- Surfaces and Interfaces
- General Physics and Astronomy
- General Chemistry
language:
- iso: eng
publication: Applied Surface Science
publication_identifier:
  issn:
  - 0169-4332
publication_status: published
publisher: Elsevier BV
quality_controlled: '1'
status: public
title: Challenges in the interpretation of gas core levels for the determination of
  gas-solid interactions within dielectric porous films by ambient pressure XPS
type: journal_article
user_id: '23547'
volume: 604
year: '2022'
...
---
_id: '33685'
abstract:
- lang: eng
  text: In the spatial confinement of cylindrical mesopores with diameters of a few
    nanometers, water molecules experience restrictions in hydrogen bonding. This
    leads to a different behavior regarding the molecular orientational freedom (‘structure
    of water') compared to the bulk liquid state. In addition to the pore size, the
    behavior is also strongly affected by the strength of the pore wall-to-water interactions,
    that is, the pore wall polarity. In this work, this is studied both experimentally
    and theoretically. The surface polarity of mesoporous silica (SiO2) is modified
    by functionalization with trimethylsilyl moieties, resulting in a change from
    a hydrophilic (pristine) to a hydrophobic pore wall. The mesopore surface is characterized
    by N2 and H2O sorption experiments. Those results are combined with IR spectroscopy
    to investigate pore wall-to-water interactions leading to different structures
    of water in the mesopore. Furthermore, the water's structure is studied theoretically
    to gain deeper insight into the interfacial interactions. For this purpose, the
    structure of water is analyzed by pairing densities, coordination, and angular
    distributions with a novel adaptation of surface-specific sum-frequency generation
    calculation for pore environments.
article_number: '2200245'
article_type: original
author:
- first_name: Christian
  full_name: Weinberger, Christian
  id: '11848'
  last_name: Weinberger
- first_name: Frederik
  full_name: Zysk, Frederik
  id: '14757'
  last_name: Zysk
- first_name: Marc
  full_name: Hartmann, Marc
  last_name: Hartmann
- first_name: Naveen
  full_name: Kaliannan, Naveen
  last_name: Kaliannan
- first_name: Waldemar
  full_name: Keil, Waldemar
  last_name: Keil
- first_name: Thomas
  full_name: Kühne, Thomas
  id: '49079'
  last_name: Kühne
- first_name: Michael
  full_name: Tiemann, Michael
  id: '23547'
  last_name: Tiemann
  orcid: 0000-0003-1711-2722
citation:
  ama: Weinberger C, Zysk F, Hartmann M, et al. The Structure of Water in Silica Mesopores
    – Influence of the Pore Wall Polarity. <i>Advanced Materials Interfaces</i>. 2022;9(20).
    doi:<a href="https://doi.org/10.1002/admi.202200245">10.1002/admi.202200245</a>
  apa: Weinberger, C., Zysk, F., Hartmann, M., Kaliannan, N., Keil, W., Kühne, T.,
    &#38; Tiemann, M. (2022). The Structure of Water in Silica Mesopores – Influence
    of the Pore Wall Polarity. <i>Advanced Materials Interfaces</i>, <i>9</i>(20),
    Article 2200245. <a href="https://doi.org/10.1002/admi.202200245">https://doi.org/10.1002/admi.202200245</a>
  bibtex: '@article{Weinberger_Zysk_Hartmann_Kaliannan_Keil_Kühne_Tiemann_2022, title={The
    Structure of Water in Silica Mesopores – Influence of the Pore Wall Polarity},
    volume={9}, DOI={<a href="https://doi.org/10.1002/admi.202200245">10.1002/admi.202200245</a>},
    number={202200245}, journal={Advanced Materials Interfaces}, publisher={Wiley},
    author={Weinberger, Christian and Zysk, Frederik and Hartmann, Marc and Kaliannan,
    Naveen and Keil, Waldemar and Kühne, Thomas and Tiemann, Michael}, year={2022}
    }'
  chicago: Weinberger, Christian, Frederik Zysk, Marc Hartmann, Naveen Kaliannan,
    Waldemar Keil, Thomas Kühne, and Michael Tiemann. “The Structure of Water in Silica
    Mesopores – Influence of the Pore Wall Polarity.” <i>Advanced Materials Interfaces</i>
    9, no. 20 (2022). <a href="https://doi.org/10.1002/admi.202200245">https://doi.org/10.1002/admi.202200245</a>.
  ieee: 'C. Weinberger <i>et al.</i>, “The Structure of Water in Silica Mesopores
    – Influence of the Pore Wall Polarity,” <i>Advanced Materials Interfaces</i>,
    vol. 9, no. 20, Art. no. 2200245, 2022, doi: <a href="https://doi.org/10.1002/admi.202200245">10.1002/admi.202200245</a>.'
  mla: Weinberger, Christian, et al. “The Structure of Water in Silica Mesopores –
    Influence of the Pore Wall Polarity.” <i>Advanced Materials Interfaces</i>, vol.
    9, no. 20, 2200245, Wiley, 2022, doi:<a href="https://doi.org/10.1002/admi.202200245">10.1002/admi.202200245</a>.
  short: C. Weinberger, F. Zysk, M. Hartmann, N. Kaliannan, W. Keil, T. Kühne, M.
    Tiemann, Advanced Materials Interfaces 9 (2022).
date_created: 2022-10-11T08:17:57Z
date_updated: 2023-03-03T11:33:24Z
department:
- _id: '613'
- _id: '35'
- _id: '2'
- _id: '307'
- _id: '304'
doi: 10.1002/admi.202200245
intvolume: '         9'
issue: '20'
keyword:
- Mechanical Engineering
- Mechanics of Materials
language:
- iso: eng
main_file_link:
- open_access: '1'
  url: https://onlinelibrary.wiley.com/doi/epdf/10.1002/admi.202200245
oa: '1'
publication: Advanced Materials Interfaces
publication_identifier:
  issn:
  - 2196-7350
  - 2196-7350
publication_status: published
publisher: Wiley
quality_controlled: '1'
status: public
title: The Structure of Water in Silica Mesopores – Influence of the Pore Wall Polarity
type: journal_article
user_id: '23547'
volume: 9
year: '2022'
...
---
_id: '29376'
abstract:
- lang: eng
  text: The electrochemical properties of carbonaceous materials produced by hydrothermal
    carbonization, referred to as hydrochar, can be substantially improved by post-carbonization
    via pyrolysis. Although these materials have been widely studied for a variety
    of applications, the mechanisms underlying the pyrolysis are yet poorly understood.
    This study provides a comprehensive temperature-resolved characterization of the
    chemical composition, morphology and crystallinity of sucrose-derived hydrochar
    during pyrolysis. Thermogravimetric analysis, differential scanning calorimetry,
    and elemental analysis have shown that the dry hydrochar loses about 41% of its
    dry mass due to the exothermic disintegration of oxygen-containing groups until
    the carbonization is completed at about 850 °C with a total carbon yield of 93%.
    The carbonization and aromatization of the initially furanic and keto-aliphatic
    structure were analyzed by 13C solid-state nuclear magnetic resonance spectroscopy,
    X-ray photoelectron spectroscopy, and Fourier transform infrared spectroscopy.
    The transition from an amorphous to a nanocrystalline graphitic structure was
    analyzed using X-ray diffraction and Raman spectroscopy. The pore formation mechanism
    was examined by helium ion microscopy, transmission electron microscopy, and nitrogen
    adsorption measurements. The results indicate the formation of oxygen-rich nanoclusters
    up to 700 °C, which decompose up to 750 °C leaving behind equally sized pores,
    resulting in a surface area of up to 480 m2/g.
article_number: '105404'
article_type: original
author:
- first_name: Martin
  full_name: Wortmann, Martin
  last_name: Wortmann
- first_name: Waldemar
  full_name: Keil, Waldemar
  last_name: Keil
- first_name: Bennet
  full_name: Brockhagen, Bennet
  last_name: Brockhagen
- first_name: Jan
  full_name: Biedinger, Jan
  last_name: Biedinger
- first_name: Michael
  full_name: Westphal, Michael
  last_name: Westphal
- first_name: Christian
  full_name: Weinberger, Christian
  id: '11848'
  last_name: Weinberger
- first_name: Elise
  full_name: Diestelhorst, Elise
  last_name: Diestelhorst
- first_name: Wiebke
  full_name: Hachmann, Wiebke
  last_name: Hachmann
- first_name: Yanjing
  full_name: Zhao, Yanjing
  last_name: Zhao
- first_name: Michael
  full_name: Tiemann, Michael
  id: '23547'
  last_name: Tiemann
  orcid: 0000-0003-1711-2722
- first_name: Günter
  full_name: Reiss, Günter
  last_name: Reiss
- first_name: Bruno
  full_name: Hüsgen, Bruno
  last_name: Hüsgen
- first_name: Claudia
  full_name: Schmidt, Claudia
  id: '466'
  last_name: Schmidt
  orcid: 0000-0003-3179-9997
- first_name: Klaus
  full_name: Sattler, Klaus
  last_name: Sattler
- first_name: Natalie
  full_name: Frese, Natalie
  last_name: Frese
citation:
  ama: Wortmann M, Keil W, Brockhagen B, et al. Pyrolysis of sucrose-derived hydrochar.
    <i>Journal of Analytical and Applied Pyrolysis</i>. 2022;161. doi:<a href="https://doi.org/10.1016/j.jaap.2021.105404">10.1016/j.jaap.2021.105404</a>
  apa: Wortmann, M., Keil, W., Brockhagen, B., Biedinger, J., Westphal, M., Weinberger,
    C., Diestelhorst, E., Hachmann, W., Zhao, Y., Tiemann, M., Reiss, G., Hüsgen,
    B., Schmidt, C., Sattler, K., &#38; Frese, N. (2022). Pyrolysis of sucrose-derived
    hydrochar. <i>Journal of Analytical and Applied Pyrolysis</i>, <i>161</i>, Article
    105404. <a href="https://doi.org/10.1016/j.jaap.2021.105404">https://doi.org/10.1016/j.jaap.2021.105404</a>
  bibtex: '@article{Wortmann_Keil_Brockhagen_Biedinger_Westphal_Weinberger_Diestelhorst_Hachmann_Zhao_Tiemann_et
    al._2022, title={Pyrolysis of sucrose-derived hydrochar}, volume={161}, DOI={<a
    href="https://doi.org/10.1016/j.jaap.2021.105404">10.1016/j.jaap.2021.105404</a>},
    number={105404}, journal={Journal of Analytical and Applied Pyrolysis}, publisher={Elsevier
    BV}, author={Wortmann, Martin and Keil, Waldemar and Brockhagen, Bennet and Biedinger,
    Jan and Westphal, Michael and Weinberger, Christian and Diestelhorst, Elise and
    Hachmann, Wiebke and Zhao, Yanjing and Tiemann, Michael and et al.}, year={2022}
    }'
  chicago: Wortmann, Martin, Waldemar Keil, Bennet Brockhagen, Jan Biedinger, Michael
    Westphal, Christian Weinberger, Elise Diestelhorst, et al. “Pyrolysis of Sucrose-Derived
    Hydrochar.” <i>Journal of Analytical and Applied Pyrolysis</i> 161 (2022). <a
    href="https://doi.org/10.1016/j.jaap.2021.105404">https://doi.org/10.1016/j.jaap.2021.105404</a>.
  ieee: 'M. Wortmann <i>et al.</i>, “Pyrolysis of sucrose-derived hydrochar,” <i>Journal
    of Analytical and Applied Pyrolysis</i>, vol. 161, Art. no. 105404, 2022, doi:
    <a href="https://doi.org/10.1016/j.jaap.2021.105404">10.1016/j.jaap.2021.105404</a>.'
  mla: Wortmann, Martin, et al. “Pyrolysis of Sucrose-Derived Hydrochar.” <i>Journal
    of Analytical and Applied Pyrolysis</i>, vol. 161, 105404, Elsevier BV, 2022,
    doi:<a href="https://doi.org/10.1016/j.jaap.2021.105404">10.1016/j.jaap.2021.105404</a>.
  short: M. Wortmann, W. Keil, B. Brockhagen, J. Biedinger, M. Westphal, C. Weinberger,
    E. Diestelhorst, W. Hachmann, Y. Zhao, M. Tiemann, G. Reiss, B. Hüsgen, C. Schmidt,
    K. Sattler, N. Frese, Journal of Analytical and Applied Pyrolysis 161 (2022).
date_created: 2022-01-18T06:25:06Z
date_updated: 2023-03-08T08:15:24Z
department:
- _id: '35'
- _id: '2'
- _id: '307'
- _id: '315'
doi: 10.1016/j.jaap.2021.105404
intvolume: '       161'
keyword:
- Analytical Chemistry
- Fuel Technology
language:
- iso: eng
publication: Journal of Analytical and Applied Pyrolysis
publication_identifier:
  issn:
  - 0165-2370
publication_status: published
publisher: Elsevier BV
quality_controlled: '1'
status: public
title: Pyrolysis of sucrose-derived hydrochar
type: journal_article
user_id: '23547'
volume: 161
year: '2022'
...
---
_id: '28254'
abstract:
- lang: eng
  text: With the rapid advances of functional dielectric metasurfaces and their integration
    on on-chip nanophotonic devices, the necessity of metasurfaces working in different
    environments, especially in biological applications, arose. However, the metasurfaces’
    performance is tied to the unit cell’s efficiency and ultimately the surrounding
    environment it was designed for, thus reducing its applicability if exposed to
    altering refractive index media. Here, we report a method to increase a metasurface’s
    versatility by covering the high-index metasurface with a low index porous SiO2
    film, protecting the metasurface from environmental changes while keeping the
    working efficiency unchanged. We show, that a covered metasurface retains its
    functionality even when exposed to fluidic environments.
article_type: original
author:
- first_name: René
  full_name: Geromel, René
  last_name: Geromel
- first_name: Christian
  full_name: Weinberger, Christian
  id: '11848'
  last_name: Weinberger
- first_name: Katja
  full_name: Brormann, Katja
  last_name: Brormann
- first_name: Michael
  full_name: Tiemann, Michael
  id: '23547'
  last_name: Tiemann
  orcid: 0000-0003-1711-2722
- first_name: Thomas
  full_name: Zentgraf, Thomas
  id: '30525'
  last_name: Zentgraf
  orcid: 0000-0002-8662-1101
citation:
  ama: Geromel R, Weinberger C, Brormann K, Tiemann M, Zentgraf T. Porous SiO2 coated
    dielectric metasurface with consistent performance independent of environmental
    conditions. <i>Optical Materials Express</i>. 2022;12(1):13-21. doi:<a href="https://doi.org/10.1364/ome.444264">10.1364/ome.444264</a>
  apa: Geromel, R., Weinberger, C., Brormann, K., Tiemann, M., &#38; Zentgraf, T.
    (2022). Porous SiO2 coated dielectric metasurface with consistent performance
    independent of environmental conditions. <i>Optical Materials Express</i>, <i>12</i>(1),
    13–21. <a href="https://doi.org/10.1364/ome.444264">https://doi.org/10.1364/ome.444264</a>
  bibtex: '@article{Geromel_Weinberger_Brormann_Tiemann_Zentgraf_2022, title={Porous
    SiO2 coated dielectric metasurface with consistent performance independent of
    environmental conditions}, volume={12}, DOI={<a href="https://doi.org/10.1364/ome.444264">10.1364/ome.444264</a>},
    number={1}, journal={Optical Materials Express}, publisher={Optica}, author={Geromel,
    René and Weinberger, Christian and Brormann, Katja and Tiemann, Michael and Zentgraf,
    Thomas}, year={2022}, pages={13–21} }'
  chicago: 'Geromel, René, Christian Weinberger, Katja Brormann, Michael Tiemann,
    and Thomas Zentgraf. “Porous SiO2 Coated Dielectric Metasurface with Consistent
    Performance Independent of Environmental Conditions.” <i>Optical Materials Express</i>
    12, no. 1 (2022): 13–21. <a href="https://doi.org/10.1364/ome.444264">https://doi.org/10.1364/ome.444264</a>.'
  ieee: 'R. Geromel, C. Weinberger, K. Brormann, M. Tiemann, and T. Zentgraf, “Porous
    SiO2 coated dielectric metasurface with consistent performance independent of
    environmental conditions,” <i>Optical Materials Express</i>, vol. 12, no. 1, pp.
    13–21, 2022, doi: <a href="https://doi.org/10.1364/ome.444264">10.1364/ome.444264</a>.'
  mla: Geromel, René, et al. “Porous SiO2 Coated Dielectric Metasurface with Consistent
    Performance Independent of Environmental Conditions.” <i>Optical Materials Express</i>,
    vol. 12, no. 1, Optica, 2022, pp. 13–21, doi:<a href="https://doi.org/10.1364/ome.444264">10.1364/ome.444264</a>.
  short: R. Geromel, C. Weinberger, K. Brormann, M. Tiemann, T. Zentgraf, Optical
    Materials Express 12 (2022) 13–21.
date_created: 2021-12-02T18:47:42Z
date_updated: 2023-03-08T08:13:58Z
department:
- _id: '15'
- _id: '230'
- _id: '289'
- _id: '623'
- _id: '2'
- _id: '35'
- _id: '307'
doi: 10.1364/ome.444264
intvolume: '        12'
issue: '1'
language:
- iso: eng
main_file_link:
- open_access: '1'
  url: https://www.osapublishing.org/ome/fulltext.cfm?uri=ome-12-1-13&id=465602
oa: '1'
page: 13-21
publication: Optical Materials Express
publication_identifier:
  issn:
  - 2159-3930
publication_status: published
publisher: Optica
quality_controlled: '1'
status: public
title: Porous SiO2 coated dielectric metasurface with consistent performance independent
  of environmental conditions
type: journal_article
user_id: '23547'
volume: 12
year: '2022'
...
---
_id: '33965'
author:
- first_name: Adriana
  full_name: Bocchini, Adriana
  id: '58349'
  last_name: Bocchini
  orcid: 0000-0002-2134-3075
- first_name: Uwe
  full_name: Gerstmann, Uwe
  id: '171'
  last_name: Gerstmann
  orcid: 0000-0002-4476-223X
- first_name: Tim
  full_name: Bartley, Tim
  id: '49683'
  last_name: Bartley
- first_name: Hans-Georg
  full_name: Steinrück, Hans-Georg
  id: '84268'
  last_name: Steinrück
  orcid: 0000-0001-6373-0877
- first_name: Gerald
  full_name: Henkel, Gerald
  last_name: Henkel
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: Bocchini A, Gerstmann U, Bartley T, Steinrück H-G, Henkel G, Schmidt WG. Electrochemical
    performance of KTiOAsO_4 (KTA) in potassium-ion batteries from density-functional
    theory. <i>Phys Rev Materials</i>. 2022;6:105401. doi:<a href="https://doi.org/10.1103/PhysRevMaterials.6.105401">10.1103/PhysRevMaterials.6.105401</a>
  apa: Bocchini, A., Gerstmann, U., Bartley, T., Steinrück, H.-G., Henkel, G., &#38;
    Schmidt, W. G. (2022). Electrochemical performance of KTiOAsO_4 (KTA) in potassium-ion
    batteries from density-functional theory. <i>Phys. Rev. Materials</i>, <i>6</i>,
    105401. <a href="https://doi.org/10.1103/PhysRevMaterials.6.105401">https://doi.org/10.1103/PhysRevMaterials.6.105401</a>
  bibtex: '@article{Bocchini_Gerstmann_Bartley_Steinrück_Henkel_Schmidt_2022, title={Electrochemical
    performance of KTiOAsO_4 (KTA) in potassium-ion batteries from density-functional
    theory}, volume={6}, DOI={<a href="https://doi.org/10.1103/PhysRevMaterials.6.105401">10.1103/PhysRevMaterials.6.105401</a>},
    journal={Phys. Rev. Materials}, publisher={American Physical Society}, author={Bocchini,
    Adriana and Gerstmann, Uwe and Bartley, Tim and Steinrück, Hans-Georg and Henkel,
    Gerald and Schmidt, Wolf Gero}, year={2022}, pages={105401} }'
  chicago: 'Bocchini, Adriana, Uwe Gerstmann, Tim Bartley, Hans-Georg Steinrück, Gerald
    Henkel, and Wolf Gero Schmidt. “Electrochemical Performance of KTiOAsO_4 (KTA)
    in Potassium-Ion Batteries from Density-Functional Theory.” <i>Phys. Rev. Materials</i>
    6 (2022): 105401. <a href="https://doi.org/10.1103/PhysRevMaterials.6.105401">https://doi.org/10.1103/PhysRevMaterials.6.105401</a>.'
  ieee: 'A. Bocchini, U. Gerstmann, T. Bartley, H.-G. Steinrück, G. Henkel, and W.
    G. Schmidt, “Electrochemical performance of KTiOAsO_4 (KTA) in potassium-ion batteries
    from density-functional theory,” <i>Phys. Rev. Materials</i>, vol. 6, p. 105401,
    2022, doi: <a href="https://doi.org/10.1103/PhysRevMaterials.6.105401">10.1103/PhysRevMaterials.6.105401</a>.'
  mla: Bocchini, Adriana, et al. “Electrochemical Performance of KTiOAsO_4 (KTA) in
    Potassium-Ion Batteries from Density-Functional Theory.” <i>Phys. Rev. Materials</i>,
    vol. 6, American Physical Society, 2022, p. 105401, doi:<a href="https://doi.org/10.1103/PhysRevMaterials.6.105401">10.1103/PhysRevMaterials.6.105401</a>.
  short: A. Bocchini, U. Gerstmann, T. Bartley, H.-G. Steinrück, G. Henkel, W.G. Schmidt,
    Phys. Rev. Materials 6 (2022) 105401.
date_created: 2022-10-31T15:00:19Z
date_updated: 2023-04-21T11:30:08Z
ddc:
- '530'
department:
- _id: '15'
- _id: '295'
- _id: '230'
- _id: '2'
- _id: '165'
- _id: '633'
- _id: '429'
- _id: '35'
- _id: '790'
doi: 10.1103/PhysRevMaterials.6.105401
file:
- access_level: closed
  content_type: application/pdf
  creator: adrianab
  date_created: 2022-10-31T15:05:24Z
  date_updated: 2022-10-31T15:05:24Z
  file_id: '33966'
  file_name: PhysRevMaterials.6.105401.pdf
  file_size: 3945388
  relation: main_file
  success: 1
file_date_updated: 2022-10-31T15:05:24Z
has_accepted_license: '1'
intvolume: '         6'
language:
- iso: eng
main_file_link:
- open_access: '1'
  url: https://journals.aps.org/prmaterials/abstract/10.1103/PhysRevMaterials.6.105401
oa: '1'
page: '105401'
project:
- _id: '52'
  name: 'PC2: Computing Resources Provided by the Paderborn Center for Parallel Computing'
- _id: '53'
  name: 'TRR 142: TRR 142'
- _id: '55'
  name: 'TRR 142 - B: TRR 142 - Project Area B'
- _id: '54'
  name: 'TRR 142 - A: TRR 142 - Project Area A'
- _id: '166'
  name: 'TRR 142 - A11: TRR 142 - Subproject A11'
- _id: '168'
  name: 'TRR 142 - B07: TRR 142 - Subproject B07'
publication: Phys. Rev. Materials
publication_status: published
publisher: American Physical Society
status: public
title: Electrochemical performance of KTiOAsO_4 (KTA) in potassium-ion batteries from
  density-functional theory
type: journal_article
user_id: '171'
volume: 6
year: '2022'
...
---
_id: '40154'
abstract:
- lang: eng
  text: <jats:p>The development of bioresorbable materials for temporary implantation
    enables progress in medical technology. Iron (Fe)-based degradable materials are
    biocompatible and exhibit good mechanical properties, but their degradation rate
    is low. Aside from alloying with Manganese (Mn), the creation of phases with high
    electrochemical potential such as silver (Ag) phases to cause the anodic dissolution
    of FeMn is promising. However, to enable residue-free dissolution, the Ag needs
    to be modified. This concern is addressed, as FeMn modified with a degradable
    Ag-Calcium-Lanthanum (AgCaLa) alloy is investigated. The electrochemical properties
    and the degradation behavior are determined via a static immersion test. The local
    differences in electrochemical potential increase the degradation rate (low pH
    values), and the formation of gaps around the Ag phases (neutral pH values) demonstrates
    the benefit of the strategy. Nevertheless, the formation of corrosion-inhibiting
    layers avoids an increased degradation rate under a neutral pH value. The complete
    bioresorption of the material is possible since the phases of the degradable AgCaLa
    alloy dissolve after the FeMn matrix. Cell viability tests reveal biocompatibility,
    and the antibacterial activity of the degradation supernatant is observed. Thus,
    FeMn modified with degradable AgCaLa phases is promising as a bioresorbable material
    if corrosion-inhibiting layers can be diminished.</jats:p>
author:
- first_name: Jan Tobias
  full_name: Krüger, Jan Tobias
  id: '44307'
  last_name: Krüger
  orcid: 0000-0002-0827-9654
- first_name: Kay-Peter
  full_name: Hoyer, Kay-Peter
  id: '48411'
  last_name: Hoyer
- first_name: Jingyuan
  full_name: Huang, Jingyuan
  last_name: Huang
- first_name: Viviane
  full_name: Filor, Viviane
  last_name: Filor
- first_name: Rafael Hernan
  full_name: Mateus-Vargas, Rafael Hernan
  last_name: Mateus-Vargas
- first_name: Hilke
  full_name: Oltmanns, Hilke
  last_name: Oltmanns
- first_name: Jessica
  full_name: Meißner, Jessica
  last_name: Meißner
- first_name: Guido
  full_name: Grundmeier, Guido
  id: '194'
  last_name: Grundmeier
- first_name: Mirko
  full_name: Schaper, Mirko
  id: '43720'
  last_name: Schaper
citation:
  ama: Krüger JT, Hoyer K-P, Huang J, et al. FeMn with Phases of a Degradable Ag Alloy
    for Residue-Free and Adapted Bioresorbability. <i>Journal of Functional Biomaterials</i>.
    2022;13(4):185. doi:<a href="https://doi.org/10.3390/jfb13040185">10.3390/jfb13040185</a>
  apa: Krüger, J. T., Hoyer, K.-P., Huang, J., Filor, V., Mateus-Vargas, R. H., Oltmanns,
    H., Meißner, J., Grundmeier, G., &#38; Schaper, M. (2022). FeMn with Phases of
    a Degradable Ag Alloy for Residue-Free and Adapted Bioresorbability. <i>Journal
    of Functional Biomaterials</i>, <i>13</i>(4), 185. <a href="https://doi.org/10.3390/jfb13040185">https://doi.org/10.3390/jfb13040185</a>
  bibtex: '@article{Krüger_Hoyer_Huang_Filor_Mateus-Vargas_Oltmanns_Meißner_Grundmeier_Schaper_2022,
    title={FeMn with Phases of a Degradable Ag Alloy for Residue-Free and Adapted
    Bioresorbability}, volume={13}, DOI={<a href="https://doi.org/10.3390/jfb13040185">10.3390/jfb13040185</a>},
    number={4}, journal={Journal of Functional Biomaterials}, publisher={MDPI AG},
    author={Krüger, Jan Tobias and Hoyer, Kay-Peter and Huang, Jingyuan and Filor,
    Viviane and Mateus-Vargas, Rafael Hernan and Oltmanns, Hilke and Meißner, Jessica
    and Grundmeier, Guido and Schaper, Mirko}, year={2022}, pages={185} }'
  chicago: 'Krüger, Jan Tobias, Kay-Peter Hoyer, Jingyuan Huang, Viviane Filor, Rafael
    Hernan Mateus-Vargas, Hilke Oltmanns, Jessica Meißner, Guido Grundmeier, and Mirko
    Schaper. “FeMn with Phases of a Degradable Ag Alloy for Residue-Free and Adapted
    Bioresorbability.” <i>Journal of Functional Biomaterials</i> 13, no. 4 (2022):
    185. <a href="https://doi.org/10.3390/jfb13040185">https://doi.org/10.3390/jfb13040185</a>.'
  ieee: 'J. T. Krüger <i>et al.</i>, “FeMn with Phases of a Degradable Ag Alloy for
    Residue-Free and Adapted Bioresorbability,” <i>Journal of Functional Biomaterials</i>,
    vol. 13, no. 4, p. 185, 2022, doi: <a href="https://doi.org/10.3390/jfb13040185">10.3390/jfb13040185</a>.'
  mla: Krüger, Jan Tobias, et al. “FeMn with Phases of a Degradable Ag Alloy for Residue-Free
    and Adapted Bioresorbability.” <i>Journal of Functional Biomaterials</i>, vol.
    13, no. 4, MDPI AG, 2022, p. 185, doi:<a href="https://doi.org/10.3390/jfb13040185">10.3390/jfb13040185</a>.
  short: J.T. Krüger, K.-P. Hoyer, J. Huang, V. Filor, R.H. Mateus-Vargas, H. Oltmanns,
    J. Meißner, G. Grundmeier, M. Schaper, Journal of Functional Biomaterials 13 (2022)
    185.
date_created: 2023-01-26T06:39:42Z
date_updated: 2023-04-27T16:39:26Z
department:
- _id: '302'
- _id: '158'
doi: 10.3390/jfb13040185
intvolume: '        13'
issue: '4'
keyword:
- Biomedical Engineering
- Biomaterials
language:
- iso: eng
page: '185'
publication: Journal of Functional Biomaterials
publication_identifier:
  issn:
  - 2079-4983
publication_status: published
publisher: MDPI AG
quality_controlled: '1'
status: public
title: FeMn with Phases of a Degradable Ag Alloy for Residue-Free and Adapted Bioresorbability
type: journal_article
user_id: '43720'
volume: 13
year: '2022'
...
---
_id: '34652'
article_number: '128835'
author:
- first_name: P.
  full_name: Vieth, P.
  last_name: Vieth
- first_name: M.-A.
  full_name: Garthe, M.-A.
  last_name: Garthe
- first_name: Dietrich
  full_name: Voswinkel, Dietrich
  id: '52634'
  last_name: Voswinkel
- first_name: Mirko
  full_name: Schaper, Mirko
  id: '43720'
  last_name: Schaper
- first_name: Guido
  full_name: Grundmeier, Guido
  id: '194'
  last_name: Grundmeier
citation:
  ama: Vieth P, Garthe M-A, Voswinkel D, Schaper M, Grundmeier G. Enhancement of the
    delamination resistance of adhesive film coated surface laser melted aluminum
    7075-T6 alloy by aminophosphonic acid adsorption. <i>Surface and Coatings Technology</i>.
    2022;447. doi:<a href="https://doi.org/10.1016/j.surfcoat.2022.128835">10.1016/j.surfcoat.2022.128835</a>
  apa: Vieth, P., Garthe, M.-A., Voswinkel, D., Schaper, M., &#38; Grundmeier, G.
    (2022). Enhancement of the delamination resistance of adhesive film coated surface
    laser melted aluminum 7075-T6 alloy by aminophosphonic acid adsorption. <i>Surface
    and Coatings Technology</i>, <i>447</i>, Article 128835. <a href="https://doi.org/10.1016/j.surfcoat.2022.128835">https://doi.org/10.1016/j.surfcoat.2022.128835</a>
  bibtex: '@article{Vieth_Garthe_Voswinkel_Schaper_Grundmeier_2022, title={Enhancement
    of the delamination resistance of adhesive film coated surface laser melted aluminum
    7075-T6 alloy by aminophosphonic acid adsorption}, volume={447}, DOI={<a href="https://doi.org/10.1016/j.surfcoat.2022.128835">10.1016/j.surfcoat.2022.128835</a>},
    number={128835}, journal={Surface and Coatings Technology}, publisher={Elsevier
    BV}, author={Vieth, P. and Garthe, M.-A. and Voswinkel, Dietrich and Schaper,
    Mirko and Grundmeier, Guido}, year={2022} }'
  chicago: Vieth, P., M.-A. Garthe, Dietrich Voswinkel, Mirko Schaper, and Guido Grundmeier.
    “Enhancement of the Delamination Resistance of Adhesive Film Coated Surface Laser
    Melted Aluminum 7075-T6 Alloy by Aminophosphonic Acid Adsorption.” <i>Surface
    and Coatings Technology</i> 447 (2022). <a href="https://doi.org/10.1016/j.surfcoat.2022.128835">https://doi.org/10.1016/j.surfcoat.2022.128835</a>.
  ieee: 'P. Vieth, M.-A. Garthe, D. Voswinkel, M. Schaper, and G. Grundmeier, “Enhancement
    of the delamination resistance of adhesive film coated surface laser melted aluminum
    7075-T6 alloy by aminophosphonic acid adsorption,” <i>Surface and Coatings Technology</i>,
    vol. 447, Art. no. 128835, 2022, doi: <a href="https://doi.org/10.1016/j.surfcoat.2022.128835">10.1016/j.surfcoat.2022.128835</a>.'
  mla: Vieth, P., et al. “Enhancement of the Delamination Resistance of Adhesive Film
    Coated Surface Laser Melted Aluminum 7075-T6 Alloy by Aminophosphonic Acid Adsorption.”
    <i>Surface and Coatings Technology</i>, vol. 447, 128835, Elsevier BV, 2022, doi:<a
    href="https://doi.org/10.1016/j.surfcoat.2022.128835">10.1016/j.surfcoat.2022.128835</a>.
  short: P. Vieth, M.-A. Garthe, D. Voswinkel, M. Schaper, G. Grundmeier, Surface
    and Coatings Technology 447 (2022).
date_created: 2022-12-21T09:35:17Z
date_updated: 2023-04-27T16:40:55Z
department:
- _id: '302'
doi: 10.1016/j.surfcoat.2022.128835
intvolume: '       447'
keyword:
- Materials Chemistry
- Surfaces
- Coatings and Films
- Surfaces and Interfaces
- Condensed Matter Physics
- General Chemistry
language:
- iso: eng
publication: Surface and Coatings Technology
publication_identifier:
  issn:
  - 0257-8972
publication_status: published
publisher: Elsevier BV
quality_controlled: '1'
status: public
title: Enhancement of the delamination resistance of adhesive film coated surface
  laser melted aluminum 7075-T6 alloy by aminophosphonic acid adsorption
type: journal_article
user_id: '43720'
volume: 447
year: '2022'
...
---
_id: '30103'
author:
- first_name: Jingyuan
  full_name: Huang, Jingyuan
  last_name: Huang
- first_name: Alejandro Gonzalez
  full_name: Orive, Alejandro Gonzalez
  last_name: Orive
- first_name: Jan Tobias
  full_name: Krüger, Jan Tobias
  id: '44307'
  last_name: Krüger
  orcid: 0000-0002-0827-9654
- first_name: Kay-Peter
  full_name: Hoyer, Kay-Peter
  id: '48411'
  last_name: Hoyer
- first_name: Adrian
  full_name: Keller, Adrian
  id: '48864'
  last_name: Keller
  orcid: 0000-0001-7139-3110
- first_name: Guido
  full_name: Grundmeier, Guido
  id: '194'
  last_name: Grundmeier
citation:
  ama: Huang J, Orive AG, Krüger JT, Hoyer K-P, Keller A, Grundmeier G. Influence
    of proteins on the corrosion of a conventional and selective laser beam melted
    FeMn alloy in physiological electrolytes. <i>Corrosion Science</i>. 2022;200:110186.
    doi:<a href="https://doi.org/10.1016/j.corsci.2022.110186">10.1016/j.corsci.2022.110186</a>
  apa: Huang, J., Orive, A. G., Krüger, J. T., Hoyer, K.-P., Keller, A., &#38; Grundmeier,
    G. (2022). Influence of proteins on the corrosion of a conventional and selective
    laser beam melted FeMn alloy in physiological electrolytes. <i>Corrosion Science</i>,
    <i>200</i>, 110186. <a href="https://doi.org/10.1016/j.corsci.2022.110186">https://doi.org/10.1016/j.corsci.2022.110186</a>
  bibtex: '@article{Huang_Orive_Krüger_Hoyer_Keller_Grundmeier_2022, title={Influence
    of proteins on the corrosion of a conventional and selective laser beam melted
    FeMn alloy in physiological electrolytes}, volume={200}, DOI={<a href="https://doi.org/10.1016/j.corsci.2022.110186">10.1016/j.corsci.2022.110186</a>},
    journal={Corrosion Science}, publisher={Elsevier BV}, author={Huang, Jingyuan
    and Orive, Alejandro Gonzalez and Krüger, Jan Tobias and Hoyer, Kay-Peter and
    Keller, Adrian and Grundmeier, Guido}, year={2022}, pages={110186} }'
  chicago: 'Huang, Jingyuan, Alejandro Gonzalez Orive, Jan Tobias Krüger, Kay-Peter
    Hoyer, Adrian Keller, and Guido Grundmeier. “Influence of Proteins on the Corrosion
    of a Conventional and Selective Laser Beam Melted FeMn Alloy in Physiological
    Electrolytes.” <i>Corrosion Science</i> 200 (2022): 110186. <a href="https://doi.org/10.1016/j.corsci.2022.110186">https://doi.org/10.1016/j.corsci.2022.110186</a>.'
  ieee: 'J. Huang, A. G. Orive, J. T. Krüger, K.-P. Hoyer, A. Keller, and G. Grundmeier,
    “Influence of proteins on the corrosion of a conventional and selective laser
    beam melted FeMn alloy in physiological electrolytes,” <i>Corrosion Science</i>,
    vol. 200, p. 110186, 2022, doi: <a href="https://doi.org/10.1016/j.corsci.2022.110186">10.1016/j.corsci.2022.110186</a>.'
  mla: Huang, Jingyuan, et al. “Influence of Proteins on the Corrosion of a Conventional
    and Selective Laser Beam Melted FeMn Alloy in Physiological Electrolytes.” <i>Corrosion
    Science</i>, vol. 200, Elsevier BV, 2022, p. 110186, doi:<a href="https://doi.org/10.1016/j.corsci.2022.110186">10.1016/j.corsci.2022.110186</a>.
  short: J. Huang, A.G. Orive, J.T. Krüger, K.-P. Hoyer, A. Keller, G. Grundmeier,
    Corrosion Science 200 (2022) 110186.
date_created: 2022-02-25T09:32:43Z
date_updated: 2023-04-27T16:47:42Z
department:
- _id: '302'
- _id: '158'
doi: 10.1016/j.corsci.2022.110186
intvolume: '       200'
keyword:
- General Materials Science
- General Chemical Engineering
- General Chemistry
language:
- iso: eng
page: '110186'
publication: Corrosion Science
publication_identifier:
  issn:
  - 0010-938X
publication_status: published
publisher: Elsevier BV
quality_controlled: '1'
status: public
title: Influence of proteins on the corrosion of a conventional and selective laser
  beam melted FeMn alloy in physiological electrolytes
type: journal_article
user_id: '48411'
volume: 200
year: '2022'
...
---
_id: '34654'
author:
- first_name: Ihsan Murat
  full_name: Kusoglu, Ihsan Murat
  last_name: Kusoglu
- first_name: Pascal
  full_name: Vieth, Pascal
  last_name: Vieth
- first_name: Steffen
  full_name: Heiland, Steffen
  id: '77250'
  last_name: Heiland
- first_name: Florian
  full_name: Huber, Florian
  last_name: Huber
- first_name: Arne
  full_name: Lüddecke, Arne
  last_name: Lüddecke
- first_name: Anna Rosa
  full_name: Ziefuss, Anna Rosa
  last_name: Ziefuss
- first_name: Arno
  full_name: Kwade, Arno
  last_name: Kwade
- first_name: Michael
  full_name: Schmidt, Michael
  last_name: Schmidt
- first_name: Mirko
  full_name: Schaper, Mirko
  id: '43720'
  last_name: Schaper
- first_name: Stephan
  full_name: Barcikowski, Stephan
  last_name: Barcikowski
- first_name: Guido
  full_name: Grundmeier, Guido
  id: '194'
  last_name: Grundmeier
citation:
  ama: Kusoglu IM, Vieth P, Heiland S, et al. Microstructure and corrosion properties
    of PBF-LB produced carbide nanoparticles additivated AlSi10Mg parts. <i>Procedia
    CIRP</i>. 2022;111:10-13. doi:<a href="https://doi.org/10.1016/j.procir.2022.08.046">10.1016/j.procir.2022.08.046</a>
  apa: Kusoglu, I. M., Vieth, P., Heiland, S., Huber, F., Lüddecke, A., Ziefuss, A.
    R., Kwade, A., Schmidt, M., Schaper, M., Barcikowski, S., &#38; Grundmeier, G.
    (2022). Microstructure and corrosion properties of PBF-LB produced carbide nanoparticles
    additivated AlSi10Mg parts. <i>Procedia CIRP</i>, <i>111</i>, 10–13. <a href="https://doi.org/10.1016/j.procir.2022.08.046">https://doi.org/10.1016/j.procir.2022.08.046</a>
  bibtex: '@article{Kusoglu_Vieth_Heiland_Huber_Lüddecke_Ziefuss_Kwade_Schmidt_Schaper_Barcikowski_et
    al._2022, title={Microstructure and corrosion properties of PBF-LB produced carbide
    nanoparticles additivated AlSi10Mg parts}, volume={111}, DOI={<a href="https://doi.org/10.1016/j.procir.2022.08.046">10.1016/j.procir.2022.08.046</a>},
    journal={Procedia CIRP}, publisher={Elsevier BV}, author={Kusoglu, Ihsan Murat
    and Vieth, Pascal and Heiland, Steffen and Huber, Florian and Lüddecke, Arne and
    Ziefuss, Anna Rosa and Kwade, Arno and Schmidt, Michael and Schaper, Mirko and
    Barcikowski, Stephan and et al.}, year={2022}, pages={10–13} }'
  chicago: 'Kusoglu, Ihsan Murat, Pascal Vieth, Steffen Heiland, Florian Huber, Arne
    Lüddecke, Anna Rosa Ziefuss, Arno Kwade, et al. “Microstructure and Corrosion
    Properties of PBF-LB Produced Carbide Nanoparticles Additivated AlSi10Mg Parts.”
    <i>Procedia CIRP</i> 111 (2022): 10–13. <a href="https://doi.org/10.1016/j.procir.2022.08.046">https://doi.org/10.1016/j.procir.2022.08.046</a>.'
  ieee: 'I. M. Kusoglu <i>et al.</i>, “Microstructure and corrosion properties of
    PBF-LB produced carbide nanoparticles additivated AlSi10Mg parts,” <i>Procedia
    CIRP</i>, vol. 111, pp. 10–13, 2022, doi: <a href="https://doi.org/10.1016/j.procir.2022.08.046">10.1016/j.procir.2022.08.046</a>.'
  mla: Kusoglu, Ihsan Murat, et al. “Microstructure and Corrosion Properties of PBF-LB
    Produced Carbide Nanoparticles Additivated AlSi10Mg Parts.” <i>Procedia CIRP</i>,
    vol. 111, Elsevier BV, 2022, pp. 10–13, doi:<a href="https://doi.org/10.1016/j.procir.2022.08.046">10.1016/j.procir.2022.08.046</a>.
  short: I.M. Kusoglu, P. Vieth, S. Heiland, F. Huber, A. Lüddecke, A.R. Ziefuss,
    A. Kwade, M. Schmidt, M. Schaper, S. Barcikowski, G. Grundmeier, Procedia CIRP
    111 (2022) 10–13.
date_created: 2022-12-21T09:35:47Z
date_updated: 2023-04-28T09:00:53Z
department:
- _id: '302'
doi: 10.1016/j.procir.2022.08.046
intvolume: '       111'
keyword:
- General Medicine
language:
- iso: eng
page: 10-13
publication: Procedia CIRP
publication_identifier:
  issn:
  - 2212-8271
publication_status: published
publisher: Elsevier BV
quality_controlled: '1'
status: public
title: Microstructure and corrosion properties of PBF-LB produced carbide nanoparticles
  additivated AlSi10Mg parts
type: journal_article
user_id: '43720'
volume: 111
year: '2022'
...
---
_id: '44376'
author:
- first_name: Güldeniz
  full_name: Tonbul, Güldeniz
  id: '89054'
  last_name: Tonbul
  orcid: 0000-0002-0999-9995
- first_name: 'Julian '
  full_name: 'Kappler, Julian '
  last_name: Kappler
- first_name: 'Saravanakumar '
  full_name: 'Murugan, Saravanakumar '
  last_name: Murugan
- first_name: 'Roland '
  full_name: 'Schoch, Roland '
  last_name: Schoch
- first_name: 'Michal '
  full_name: 'Nowakowski, Michal '
  last_name: Nowakowski
- first_name: 'Pia '
  full_name: 'Lange, Pia '
  last_name: Lange
- first_name: Matthias
  full_name: Bauer, Matthias
  last_name: Bauer
- first_name: Michael R.
  full_name: Buchmeiser, Michael R.
  last_name: Buchmeiser
citation:
  ama: 'Tonbul G, Kappler J, Murugan S, et al. Development of Battery System Based
    on Na-S and Characterization Using X-ray Absorption Spectroscopy. In: ; 2022.'
  apa: Tonbul, G., Kappler, J., Murugan, S., Schoch, R., Nowakowski, M., Lange, P.,
    Bauer, M., &#38; Buchmeiser, M. R. (2022). <i>Development of Battery System Based
    on Na-S and Characterization Using X-ray Absorption Spectroscopy</i>. Electrochem2022
    &#38; 63rd Corrosion Science Symposium, Edinburgh.
  bibtex: '@inproceedings{Tonbul_Kappler_Murugan_Schoch_Nowakowski_Lange_Bauer_Buchmeiser_2022,
    place={Edinburgh}, title={Development of Battery System Based on Na-S and Characterization
    Using X-ray Absorption Spectroscopy}, author={Tonbul, Güldeniz and Kappler, Julian  and
    Murugan, Saravanakumar  and Schoch, Roland  and Nowakowski, Michal  and Lange,
    Pia  and Bauer, Matthias and Buchmeiser, Michael R.}, year={2022} }'
  chicago: Tonbul, Güldeniz, Julian  Kappler, Saravanakumar  Murugan, Roland  Schoch,
    Michal  Nowakowski, Pia  Lange, Matthias Bauer, and Michael R. Buchmeiser. “Development
    of Battery System Based on Na-S and Characterization Using X-Ray Absorption Spectroscopy.”
    Edinburgh, 2022.
  ieee: G. Tonbul <i>et al.</i>, “Development of Battery System Based on Na-S and
    Characterization Using X-ray Absorption Spectroscopy,” presented at the Electrochem2022
    &#38; 63rd Corrosion Science Symposium, Edinburgh, 2022.
  mla: Tonbul, Güldeniz, et al. <i>Development of Battery System Based on Na-S and
    Characterization Using X-Ray Absorption Spectroscopy</i>. 2022.
  short: 'G. Tonbul, J. Kappler, S. Murugan, R. Schoch, M. Nowakowski, P. Lange, M.
    Bauer, M.R. Buchmeiser, in: Edinburgh, 2022.'
conference:
  end_date: 2022-09-06
  location: Edinburgh
  name: Electrochem2022 & 63rd Corrosion Science Symposium
  start_date: 2022-09-04
date_created: 2023-05-03T08:25:33Z
date_updated: 2023-05-03T08:26:41Z
department:
- _id: '306'
language:
- iso: eng
place: Edinburgh
status: public
title: Development of Battery System Based on Na-S and Characterization Using X-ray
  Absorption Spectroscopy
type: conference_abstract
user_id: '89054'
year: '2022'
...
---
_id: '45007'
author:
- first_name: Y.
  full_name: Yang, Y.
  last_name: Yang
- first_name: J.
  full_name: Cheramy, J.
  last_name: Cheramy
- first_name: Martin
  full_name: Brehm, Martin
  id: '100167'
  last_name: Brehm
- first_name: Y.
  full_name: Xu, Y.
  last_name: Xu
citation:
  ama: 'Yang Y, Cheramy J, Brehm M, Xu Y. Raman Optical Activity of N-Acetyl-L-Cysteine
    in Water and in Methanol: The “Clusters-in-a-Liquid” Model and ab initio Molecular
    Dynamics Simulations. <i>ChemPhysChem</i>. 2022;23 (11):e202200161. doi:<a href="https://doi.org/10.1002/cphc.202200161">10.1002/cphc.202200161</a>'
  apa: 'Yang, Y., Cheramy, J., Brehm, M., &#38; Xu, Y. (2022). Raman Optical Activity
    of N-Acetyl-L-Cysteine in Water and in Methanol: The “Clusters-in-a-Liquid” Model
    and ab initio Molecular Dynamics Simulations. <i>ChemPhysChem</i>, <i>23 (11)</i>,
    e202200161. <a href="https://doi.org/10.1002/cphc.202200161">https://doi.org/10.1002/cphc.202200161</a>'
  bibtex: '@article{Yang_Cheramy_Brehm_Xu_2022, title={Raman Optical Activity of N-Acetyl-L-Cysteine
    in Water and in Methanol: The “Clusters-in-a-Liquid” Model and ab initio Molecular
    Dynamics Simulations}, volume={23 (11)}, DOI={<a href="https://doi.org/10.1002/cphc.202200161">10.1002/cphc.202200161</a>},
    journal={ChemPhysChem}, author={Yang, Y. and Cheramy, J. and Brehm, Martin and
    Xu, Y.}, year={2022}, pages={e202200161} }'
  chicago: 'Yang, Y., J. Cheramy, Martin Brehm, and Y. Xu. “Raman Optical Activity
    of N-Acetyl-L-Cysteine in Water and in Methanol: The ‘Clusters-in-a-Liquid’ Model
    and Ab Initio Molecular Dynamics Simulations.” <i>ChemPhysChem</i> 23 (11) (2022):
    e202200161. <a href="https://doi.org/10.1002/cphc.202200161">https://doi.org/10.1002/cphc.202200161</a>.'
  ieee: 'Y. Yang, J. Cheramy, M. Brehm, and Y. Xu, “Raman Optical Activity of N-Acetyl-L-Cysteine
    in Water and in Methanol: The ‘Clusters-in-a-Liquid’ Model and ab initio Molecular
    Dynamics Simulations,” <i>ChemPhysChem</i>, vol. 23 (11), p. e202200161, 2022,
    doi: <a href="https://doi.org/10.1002/cphc.202200161">10.1002/cphc.202200161</a>.'
  mla: 'Yang, Y., et al. “Raman Optical Activity of N-Acetyl-L-Cysteine in Water and
    in Methanol: The ‘Clusters-in-a-Liquid’ Model and Ab Initio Molecular Dynamics
    Simulations.” <i>ChemPhysChem</i>, vol. 23 (11), 2022, p. e202200161, doi:<a href="https://doi.org/10.1002/cphc.202200161">10.1002/cphc.202200161</a>.'
  short: Y. Yang, J. Cheramy, M. Brehm, Y. Xu, ChemPhysChem 23 (11) (2022) e202200161.
date_created: 2023-05-16T20:22:05Z
date_updated: 2023-05-16T20:48:47Z
department:
- _id: '803'
doi: 10.1002/cphc.202200161
extern: '1'
language:
- iso: eng
page: e202200161
publication: ChemPhysChem
status: public
title: 'Raman Optical Activity of N-Acetyl-L-Cysteine in Water and in Methanol: The
  “Clusters-in-a-Liquid” Model and ab initio Molecular Dynamics Simulations'
type: journal_article
user_id: '100167'
volume: 23 (11)
year: '2022'
...
---
_id: '45010'
author:
- first_name: R.
  full_name: Chahal, R.
  last_name: Chahal
- first_name: S.
  full_name: Roy, S.
  last_name: Roy
- first_name: Martin
  full_name: Brehm, Martin
  id: '100167'
  last_name: Brehm
- first_name: S.
  full_name: Banerjee, S.
  last_name: Banerjee
- first_name: V.
  full_name: Bryantsev, V.
  last_name: Bryantsev
- first_name: S.
  full_name: Lam, S.
  last_name: Lam
citation:
  ama: Chahal R, Roy S, Brehm M, Banerjee S, Bryantsev V, Lam S. Transferable Deep
    Learning Potential Reveals Intermediate-Range Ordering Effects in LiF–NaF–ZrF4
    Molten Salt. <i>JACS Au</i>. 2022;2 (12):2693-2702. doi:<a href="https://doi.org/10.1021/jacsau.2c00526">10.1021/jacsau.2c00526</a>
  apa: Chahal, R., Roy, S., Brehm, M., Banerjee, S., Bryantsev, V., &#38; Lam, S.
    (2022). Transferable Deep Learning Potential Reveals Intermediate-Range Ordering
    Effects in LiF–NaF–ZrF4 Molten Salt. <i>JACS Au</i>, <i>2 (12)</i>, 2693–2702.
    <a href="https://doi.org/10.1021/jacsau.2c00526">https://doi.org/10.1021/jacsau.2c00526</a>
  bibtex: '@article{Chahal_Roy_Brehm_Banerjee_Bryantsev_Lam_2022, title={Transferable
    Deep Learning Potential Reveals Intermediate-Range Ordering Effects in LiF–NaF–ZrF4
    Molten Salt}, volume={2 (12)}, DOI={<a href="https://doi.org/10.1021/jacsau.2c00526">10.1021/jacsau.2c00526</a>},
    journal={JACS Au}, author={Chahal, R. and Roy, S. and Brehm, Martin and Banerjee,
    S. and Bryantsev, V. and Lam, S.}, year={2022}, pages={2693–2702} }'
  chicago: 'Chahal, R., S. Roy, Martin Brehm, S. Banerjee, V. Bryantsev, and S. Lam.
    “Transferable Deep Learning Potential Reveals Intermediate-Range Ordering Effects
    in LiF–NaF–ZrF4 Molten Salt.” <i>JACS Au</i> 2 (12) (2022): 2693–2702. <a href="https://doi.org/10.1021/jacsau.2c00526">https://doi.org/10.1021/jacsau.2c00526</a>.'
  ieee: 'R. Chahal, S. Roy, M. Brehm, S. Banerjee, V. Bryantsev, and S. Lam, “Transferable
    Deep Learning Potential Reveals Intermediate-Range Ordering Effects in LiF–NaF–ZrF4
    Molten Salt,” <i>JACS Au</i>, vol. 2 (12), pp. 2693–2702, 2022, doi: <a href="https://doi.org/10.1021/jacsau.2c00526">10.1021/jacsau.2c00526</a>.'
  mla: Chahal, R., et al. “Transferable Deep Learning Potential Reveals Intermediate-Range
    Ordering Effects in LiF–NaF–ZrF4 Molten Salt.” <i>JACS Au</i>, vol. 2 (12), 2022,
    pp. 2693–702, doi:<a href="https://doi.org/10.1021/jacsau.2c00526">10.1021/jacsau.2c00526</a>.
  short: R. Chahal, S. Roy, M. Brehm, S. Banerjee, V. Bryantsev, S. Lam, JACS Au 2
    (12) (2022) 2693–2702.
date_created: 2023-05-16T20:22:05Z
date_updated: 2023-05-16T20:48:09Z
department:
- _id: '803'
doi: 10.1021/jacsau.2c00526
extern: '1'
language:
- iso: eng
page: 2693-2702
publication: JACS Au
status: public
title: Transferable Deep Learning Potential Reveals Intermediate-Range Ordering Effects
  in LiF–NaF–ZrF4 Molten Salt
type: journal_article
user_id: '100167'
volume: 2 (12)
year: '2022'
...
---
_id: '45008'
author:
- first_name: S.
  full_name: Taherivardanjani, S.
  last_name: Taherivardanjani
- first_name: J.
  full_name: Blasius, J.
  last_name: Blasius
- first_name: Martin
  full_name: Brehm, Martin
  id: '100167'
  last_name: Brehm
- first_name: R.
  full_name: Dötzer, R.
  last_name: Dötzer
- first_name: B.
  full_name: Kirchner, B.
  last_name: Kirchner
citation:
  ama: Taherivardanjani S, Blasius J, Brehm M, Dötzer R, Kirchner B. Conformer Weighting
    and Differently Sized Cluster Weighting for Nicotine and its Phosphorus Derivatives.
    <i>J Phys Chem A</i>. 2022;126 (40):7070-7083. doi:<a href="https://doi.org/10.1021/acs.jpca.2c03133">10.1021/acs.jpca.2c03133</a>
  apa: Taherivardanjani, S., Blasius, J., Brehm, M., Dötzer, R., &#38; Kirchner, B.
    (2022). Conformer Weighting and Differently Sized Cluster Weighting for Nicotine
    and its Phosphorus Derivatives. <i>J. Phys. Chem. A</i>, <i>126 (40)</i>, 7070–7083.
    <a href="https://doi.org/10.1021/acs.jpca.2c03133">https://doi.org/10.1021/acs.jpca.2c03133</a>
  bibtex: '@article{Taherivardanjani_Blasius_Brehm_Dötzer_Kirchner_2022, title={Conformer
    Weighting and Differently Sized Cluster Weighting for Nicotine and its Phosphorus
    Derivatives}, volume={126 (40)}, DOI={<a href="https://doi.org/10.1021/acs.jpca.2c03133">10.1021/acs.jpca.2c03133</a>},
    journal={J. Phys. Chem. A}, author={Taherivardanjani, S. and Blasius, J. and Brehm,
    Martin and Dötzer, R. and Kirchner, B.}, year={2022}, pages={7070–7083} }'
  chicago: 'Taherivardanjani, S., J. Blasius, Martin Brehm, R. Dötzer, and B. Kirchner.
    “Conformer Weighting and Differently Sized Cluster Weighting for Nicotine and
    Its Phosphorus Derivatives.” <i>J. Phys. Chem. A</i> 126 (40) (2022): 7070–83.
    <a href="https://doi.org/10.1021/acs.jpca.2c03133">https://doi.org/10.1021/acs.jpca.2c03133</a>.'
  ieee: 'S. Taherivardanjani, J. Blasius, M. Brehm, R. Dötzer, and B. Kirchner, “Conformer
    Weighting and Differently Sized Cluster Weighting for Nicotine and its Phosphorus
    Derivatives,” <i>J. Phys. Chem. A</i>, vol. 126 (40), pp. 7070–7083, 2022, doi:
    <a href="https://doi.org/10.1021/acs.jpca.2c03133">10.1021/acs.jpca.2c03133</a>.'
  mla: Taherivardanjani, S., et al. “Conformer Weighting and Differently Sized Cluster
    Weighting for Nicotine and Its Phosphorus Derivatives.” <i>J. Phys. Chem. A</i>,
    vol. 126 (40), 2022, pp. 7070–83, doi:<a href="https://doi.org/10.1021/acs.jpca.2c03133">10.1021/acs.jpca.2c03133</a>.
  short: S. Taherivardanjani, J. Blasius, M. Brehm, R. Dötzer, B. Kirchner, J. Phys.
    Chem. A 126 (40) (2022) 7070–7083.
date_created: 2023-05-16T20:22:05Z
date_updated: 2023-05-16T20:48:36Z
department:
- _id: '803'
doi: 10.1021/acs.jpca.2c03133
extern: '1'
language:
- iso: eng
page: 7070-7083
publication: J. Phys. Chem. A
status: public
title: Conformer Weighting and Differently Sized Cluster Weighting for Nicotine and
  its Phosphorus Derivatives
type: journal_article
user_id: '100167'
volume: 126 (40)
year: '2022'
...
---
_id: '45009'
author:
- first_name: T.
  full_name: Frömbgen, T.
  last_name: Frömbgen
- first_name: J.
  full_name: Blasius, J.
  last_name: Blasius
- first_name: V.
  full_name: Alizadeh, V.
  last_name: Alizadeh
- first_name: A.
  full_name: Chaumont, A.
  last_name: Chaumont
- first_name: Martin
  full_name: Brehm, Martin
  id: '100167'
  last_name: Brehm
- first_name: B.
  full_name: Kirchner, B.
  last_name: Kirchner
citation:
  ama: 'Frömbgen T, Blasius J, Alizadeh V, Chaumont A, Brehm M, Kirchner B. Cluster
    Analysis in Liquids: A Novel Tool in TRAVIS. <i>J Chem Inf Model</i>. 2022;62
    (22):5634-5644. doi:<a href="https://doi.org/10.1021/acs.jcim.2c01244">10.1021/acs.jcim.2c01244</a>'
  apa: 'Frömbgen, T., Blasius, J., Alizadeh, V., Chaumont, A., Brehm, M., &#38; Kirchner,
    B. (2022). Cluster Analysis in Liquids: A Novel Tool in TRAVIS. <i>J. Chem. Inf.
    Model.</i>, <i>62 (22)</i>, 5634–5644. <a href="https://doi.org/10.1021/acs.jcim.2c01244">https://doi.org/10.1021/acs.jcim.2c01244</a>'
  bibtex: '@article{Frömbgen_Blasius_Alizadeh_Chaumont_Brehm_Kirchner_2022, title={Cluster
    Analysis in Liquids: A Novel Tool in TRAVIS}, volume={62 (22)}, DOI={<a href="https://doi.org/10.1021/acs.jcim.2c01244">10.1021/acs.jcim.2c01244</a>},
    journal={J. Chem. Inf. Model.}, author={Frömbgen, T. and Blasius, J. and Alizadeh,
    V. and Chaumont, A. and Brehm, Martin and Kirchner, B.}, year={2022}, pages={5634–5644}
    }'
  chicago: 'Frömbgen, T., J. Blasius, V. Alizadeh, A. Chaumont, Martin Brehm, and
    B. Kirchner. “Cluster Analysis in Liquids: A Novel Tool in TRAVIS.” <i>J. Chem.
    Inf. Model.</i> 62 (22) (2022): 5634–44. <a href="https://doi.org/10.1021/acs.jcim.2c01244">https://doi.org/10.1021/acs.jcim.2c01244</a>.'
  ieee: 'T. Frömbgen, J. Blasius, V. Alizadeh, A. Chaumont, M. Brehm, and B. Kirchner,
    “Cluster Analysis in Liquids: A Novel Tool in TRAVIS,” <i>J. Chem. Inf. Model.</i>,
    vol. 62 (22), pp. 5634–5644, 2022, doi: <a href="https://doi.org/10.1021/acs.jcim.2c01244">10.1021/acs.jcim.2c01244</a>.'
  mla: 'Frömbgen, T., et al. “Cluster Analysis in Liquids: A Novel Tool in TRAVIS.”
    <i>J. Chem. Inf. Model.</i>, vol. 62 (22), 2022, pp. 5634–44, doi:<a href="https://doi.org/10.1021/acs.jcim.2c01244">10.1021/acs.jcim.2c01244</a>.'
  short: T. Frömbgen, J. Blasius, V. Alizadeh, A. Chaumont, M. Brehm, B. Kirchner,
    J. Chem. Inf. Model. 62 (22) (2022) 5634–5644.
date_created: 2023-05-16T20:22:05Z
date_updated: 2023-05-16T20:48:22Z
department:
- _id: '803'
doi: 10.1021/acs.jcim.2c01244
extern: '1'
language:
- iso: eng
page: 5634-5644
publication: J. Chem. Inf. Model.
status: public
title: 'Cluster Analysis in Liquids: A Novel Tool in TRAVIS'
type: journal_article
user_id: '100167'
volume: 62 (22)
year: '2022'
...
