Analysis of vibronic coupling in a 4f molecular magnet with FIRMS

  • Jon Kragskow (Creator)
  • Jonathan Marbey (Creator)
  • Christian Dirk Buch (Creator)
  • Joscha Nehrkorn (Creator)
  • Mykhaylo Ozerov (Creator)
  • Stergios Piligkos (Creator)
  • Stephen Hill (Creator)
  • Nicholas Chilton (Creator)

Dataset

Description

OpenMOLCAS and Gaussian output files, FIRMS data (simulated and experimental), and luminescence data.
Date made available7 Feb 2022
PublisherUniversity of Manchester figshare

Keywords

  • spin-phonon coupling
  • vibronic coupling
  • FIRMS
  • molecular qubit
  • single molecule magnets
  • computational chemistry

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