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

I. Vela-Peréz; F. Ota; A. Mhamdi; Y. Tamura; J. Rist; N. Melzer; S. Uerken; G. Nalin; N. Anders; D. You; M. Kircher; C. Janke; M. Waitz; F. Trinter; R. Guillemin; M. N. Piancastelli; M. Simon; V. T. Davis; J. B. Williams; R. Dörner; K. Hatada; K. Yamazaki; K. Fehre; Ph V. Demekhin; K. Ueda; M. S. Schöffler; T. Jahnke

doi:10.1039/d2cp05942h

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

I. Vela-Peréz, F. Ota, A. Mhamdi, Y. Tamura, J. Rist, N. Melzer, S. Uerken, G. Nalin, N. Anders, D. You, M. Kircher, C. Janke, M. Waitz, F. Trinter^*, R. Guillemin, M. N. Piancastelli, M. Simon, V. T. Davis, J. B. Williams, R. DörnerK. Hatada, K. Yamazaki, K. Fehre, Ph V. Demekhin^*, K. Ueda, M. S. Schöffler, T. Jahnke^*

^*Corresponding author for this work

Department of Physics

Research output: Contribution to journal › Article › peer-review

8 Scopus citations

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.

Original language	English
Journal	Physical Chemistry Chemical Physics
DOIs	https://doi.org/10.1039/d2cp05942h
State	Accepted/In press - 2023

ASJC Scopus subject areas

General Physics and Astronomy
Physical and Theoretical Chemistry

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10.1039/d2cp05942h

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Vela-Peréz, I., Ota, F., Mhamdi, A., Tamura, Y., Rist, J., Melzer, N., Uerken, S., Nalin, G., Anders, N., You, D., Kircher, M., Janke, C., Waitz, M., Trinter, F., Guillemin, R., Piancastelli, M. N., Simon, M., Davis, V. T., Williams, J. B., ... Jahnke, T. (Accepted/In press). High-energy molecular-frame photoelectron angular distributions: a molecular bond-length ruler. Physical Chemistry Chemical Physics. https://doi.org/10.1039/d2cp05942h

@article{3d2e4e603f7d4d3b830be401179c7952,

title = "High-energy molecular-frame photoelectron angular distributions: a molecular bond-length ruler",

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.",

author = "I. Vela-Per{\'e}z and F. Ota and A. Mhamdi and Y. Tamura and J. Rist and N. Melzer and S. Uerken and G. Nalin and N. Anders and D. You and M. Kircher and C. Janke and M. Waitz and F. Trinter and R. Guillemin and Piancastelli, {M. N.} and M. Simon and Davis, {V. T.} and Williams, {J. B.} and R. D{\"o}rner and K. Hatada and K. Yamazaki and K. Fehre and Demekhin, {Ph V.} and K. Ueda and Sch{\"o}ffler, {M. S.} and T. Jahnke",

note = "Publisher Copyright: {\textcopyright} 2023 The Royal Society of Chemistry.",

year = "2023",

doi = "10.1039/d2cp05942h",

language = "英語",

journal = "Physical Chemistry Chemical Physics",

issn = "1463-9076",

publisher = "Royal Society of Chemistry",

}

Vela-Peréz, I, Ota, F, Mhamdi, A, Tamura, Y, Rist, J, Melzer, N, Uerken, S, Nalin, G, Anders, N, You, D, Kircher, M, Janke, C, Waitz, M, Trinter, F, Guillemin, R, Piancastelli, MN, Simon, M, Davis, VT, Williams, JB, Dörner, R, Hatada, K, Yamazaki, K, Fehre, K, Demekhin, PV, Ueda, K, Schöffler, MS & Jahnke, T 2023, 'High-energy molecular-frame photoelectron angular distributions: a molecular bond-length ruler', Physical Chemistry Chemical Physics. https://doi.org/10.1039/d2cp05942h

TY - JOUR

T1 - High-energy molecular-frame photoelectron angular distributions

T2 - a molecular bond-length ruler

AU - Vela-Peréz, I.

AU - Ota, F.

AU - Mhamdi, A.

AU - Tamura, Y.

AU - Rist, J.

AU - Melzer, N.

AU - Uerken, S.

AU - Nalin, G.

AU - Anders, N.

AU - You, D.

AU - Kircher, M.

AU - Janke, C.

AU - Waitz, M.

AU - Trinter, F.

AU - Guillemin, R.

AU - Piancastelli, M. N.

AU - Simon, M.

AU - Davis, V. T.

AU - Williams, J. B.

AU - Dörner, R.

AU - Hatada, K.

AU - Yamazaki, K.

AU - Fehre, K.

AU - Demekhin, Ph V.

AU - Ueda, K.

AU - Schöffler, M. S.

AU - Jahnke, T.

PY - 2023

Y1 - 2023

N2 - 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.

AB - 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.

UR - http://www.scopus.com/inward/record.url?scp=85159165556&partnerID=8YFLogxK

U2 - 10.1039/d2cp05942h

DO - 10.1039/d2cp05942h

M3 - 学術論文

C2 - 37159272

AN - SCOPUS:85159165556

SN - 1463-9076

JO - Physical Chemistry Chemical Physics

JF - Physical Chemistry Chemical Physics

ER -

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

Abstract

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