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  High-energy molecular-frame photoelectron angular distributions: a molecular bond-length ruler

Vela-Peréz, I., Ota, F., Mhamdi, A., Tamura, Y., Rist, J., Melzer, N., et al. (2023). High-energy molecular-frame photoelectron angular distributions: a molecular bond-length ruler. Physical Chemistry Chemical Physics, 25(19), 13784-13791. doi:10.1039/d2cp05942h.

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Item Permalink: https://hdl.handle.net/21.11116/0000-000D-2F4F-8 Version Permalink: https://hdl.handle.net/21.11116/0000-000D-3037-F
Genre: Journal Article

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2023
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 Creators:
Vela-Peréz, I., Author
Ota, F., Author
Mhamdi, A., Author
Tamura, Y., Author
Rist, J., Author
Melzer, N., Author
Uerken, S., Author
Nalin, G., Author
Anders, N., Author
You, D., Author
Kircher, M., Author
Janke, C., Author
Waitz, M., Author
Trinter, Florian1, Author           
Guillemin, R., Author
Piancastelli, M. N., Author
Simon, M., Author
Davis, V. T., Author
Williams, J. B., Author
Dörner, R., Author
Hatada, K., AuthorYamazaki, K., AuthorFehre, K., AuthorDemekhin, Ph. V., AuthorUeda, K., AuthorSchöffler, M. S., AuthorJahnke, T., Author more..
Affiliations:
1Molecular Physics, Fritz Haber Institute, Max Planck Society, ou_634545              

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 Abstract: We present a study on molecular-frame photoelectron angular distributions (MFPADs) of small molecules using circularly polarized synchrotron light. We find that the main forward-scattering peaks of the MFPADs are slightly tilted with respect to the molecular axis. This tilt angle is directly connected to the molecular bond length by a simple, universal formula. We apply the derived formula to several examples of MFPADs of C 1s and O 1s photoelectrons of CO, which have been measured experimentally or obtained by means of ab initio modeling. In addition, we discuss the influence of the back-scattering contribution that is superimposed over the analyzed forward-scattering peak in the case of homo-nuclear diatomic molecules such as N2.

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Language(s): eng - English
 Dates: 2022-12-202023-04-122023-04-172023-05-21
 Publication Status: Issued
 Pages: 8
 Publishing info: -
 Table of Contents: -
 Rev. Type: Peer
 Identifiers: DOI: 10.1039/d2cp05942h
 Degree: -

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Title: Physical Chemistry Chemical Physics
  Abbreviation : Phys. Chem. Chem. Phys.
Source Genre: Journal
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Publ. Info: Cambridge, England : Royal Society of Chemistry
Pages: 8 Volume / Issue: 25 (19) Sequence Number: - Start / End Page: 13784 - 13791 Identifier: ISSN: 1463-9076
CoNE: https://pure.mpg.de/cone/journals/resource/954925272413_1