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Comp-Photo-Chem
The Group of Felix Plasser at Loughborough

OpenMolcas

10th OpenMolcas Developers’ Workshop

FelixJune 9, 2022

Tomorrow, Felix will give a talk at the 10th OpenMolcas Develepors’ Workshop.

Content covered

  • Applications of OpenMolcas to compute luminescence spectra of lanthanide complexes
  • The Columbus/OpenMolcas interface and the new Columbus open-source release
Software, Talk OpenMolcas, Quantum chemistry

News

  • Interview – EuChemS magazine July 24, 2023
  • Release of TheoDORE 3.1 June 13, 2023
  • Chemical Science – Cover Art May 22, 2023
  • Excited-state aromaticity in naphthalene April 17, 2023
  • HOMO/LUMO transitions April 6, 2023

Categories

  • Literature
  • News
  • Paper
  • Poster
  • Preprint
  • Software
  • Talk
  • Uncategorized

Tags

aromaticity Columbus Dynamics exciton Lanthanides OpenMolcas Photochemistry Quantum chemistry Software Spectroscopy Synthesis TheoDORE Transition metal complexes Two-photon absorption Updates Wavefunction analysis
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