Threshold Photoelectron Spectroscopy of Monosulfur Monofluoride

The study employs threshold photoelectron spectroscopy (TPES) using vacuum ultraviolet synchrotron radiation to refine spectroscopic constants and fundamental energies of monosulfur monofluoride (SF). High-precision adiabatic ionization energy (AIE) measurements are achieved that could serve as benchmarks for future calculation of heat of formation of SF and its ionized form, SF<sup>+</sup>. Experimental methods utilized include a microwave discharge reactor coupled with synchrotron-based spectroscopy, providing TPES and photoion yield spectra of SF. Analysis supported by ab initio calculations enables the determination of key spectroscopic parameters, including vibrational constants and ionization thresholds. The resulting AIE of 10.195(5) eV is the most accurate value to date, enhancing the reliability of thermochemical databases.

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Publication Details

Journal
ChemPhysChem
Published
2025-05-20
DOI
https://doi.org/10.1002/cphc.202500211
Primary Topic
Inorganic Fluorides and Related Compounds
Type
article
Field-Weighted Citation Impact
0.00

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article

Threshold Photoelectron Spectroscopy of Monosulfur Monofluoride

Bérenger Gans, Jean‐Christophe Loison, Séverine Boyé-Péronne, Ugo Jacovella et al.
ChemPhysChem
Inorganic Fluorides and Related Compounds
article

Threshold Photoelectron Spectroscopy of Monosulfur Monofluoride

Bérenger Gans, Jean‐Christophe Loison, Séverine Boyé-Péronne, Ugo Jacovella, Myriam Drissi, Meng-Xu Jiang, Gustavo A. García, Hai Linh Le
article en

Abstract

The study employs threshold photoelectron spectroscopy (TPES) using vacuum ultraviolet synchrotron radiation to refine spectroscopic constants and fundamental energies of monosulfur monofluoride (SF). High-precision adiabatic ionization energy (AIE) measurements are achieved that could serve as benchmarks for future calculation of heat of formation of SF and its ionized form, SF<sup>+</sup>. Experimental methods utilized include a microwave discharge reactor coupled with synchrotron-based spectroscopy, providing TPES and photoion yield spectra of SF. Analysis supported by ab initio calculations enables the determination of key spectroscopic parameters, including vibrational constants and ionization thresholds. The resulting AIE of 10.195(5) eV is the most accurate value to date, enhancing the reliability of thermochemical databases.

ChemPhysChemVol. 26(15)
Université Paris-Sud (FR), Centre National de la Recherche Scientifique (FR), Université de Bordeaux (FR), Université Paris-Saclay (FR), Synchrotron soleil (FR), Institut des Sciences Moléculaires (FR), Institut des Sciences Moléculaires d'Orsay (FR)
Agence Nationale de la Recherche
Affordable and clean energy
Openalex Percentile: Top 91%
Inorganic Fluorides and Related Compounds
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Threshold Photoelectron Spectroscopy of Monosulfur Monofluoride — Bérenger Gans, Jean‐Christophe Loison, et al. · ChemPhysChem (2025) | TGRS Research Map | TGRS