TheoDORE 1.7.2

TheoDORE 1.7.2
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Download version 1.7.2 of the wavefunction analysis program TheoDORE below. New features of TheoDORE 1.7.2:

  • Automatic fragment generation (analyze_correlations.py) by Sebastian Mai
  • Fix for ricc2 with symmetry + read_binary + Om_formula=2
  • Improved orbkit interface
  • ORCA: read binary file
  • Interface to orbkit for extended orbital/density plotting capabilities
Size: 11 M
Version: 1.7.2