Published March 22, 2025 | Version v1
Dataset Open

Supplementary material for "Vacuum ultraviolet spectroscopy of pyrimidine derivatives: effect of halogenation"

Authors/Creators

  • 1. ROR icon Université Toulouse III - Paul Sabatier
  • 2. Universidade NOVA de Lisboa Faculdade de Ciências e Tecnologia
  • 3. Universidade Nova de Lisboa Faculdade de Ciências e Tecnologia
  • 4. ROR icon Aarhus University
  • 5. ROR icon Universidade Nova de Lisboa

Contributors

  • 1. ROR icon Université Toulouse III - Paul Sabatier
  • 2. Universidade NOVA de Lisboa Faculdade de Ciências e Tecnologia
  • 3. Universidade Nova de Lisboa Faculdade de Ciências e Tecnologia
  • 4. ROR icon Aarhus University
  • 5. ROR icon Universidade Nova de Lisboa

Description

Dataset of "Vacuum ultraviolet spectroscopy of pyrimidine derivatives: effect of halogenation"

Photoabsorption cross section for 2-chloropyrimidine in the 3.7–10.8 eV range are included as obtained experimentally and by different theoretical approximations.

  • Experimental spectrum
  • Nuclear ensemble approach
  • Vertical approximation
  • Franck–Condon Herzberg–Teller approximation

Files

Files (409.2 kB)

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md5:72c9f1a0325657bad36a3e3f8739af7a
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Additional details

Dates

Submitted
2025-03-22