Dataset: Electronic Spectra of Ytterbium Fluoride from Relativistic Electronic Structure Calculations

  • Kenneth G. Dyall (Contributor)
  • Johann V. Pototschnig (Graz University of Technology, Vrije Universiteit Amsterdam) (Contributor)
  • Andr? Severo Pereira Gomes (Contributor)
  • Luuk Visscher (Contributor)

Dataset / Software

Description

This is the dataset for the manuscript entitled: "Electronic Spectra of Ytterbium Fluoride from Relativistic Electronic Structure Calculations" by J. V. Pototschnig, K. G. Dyall, L. Visscher and A. S. P. Gomes. It contains output files of various calculations and scripts to process them.
Date made available23 Jul 2021
PublisherZenodo

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