Visualisation and GAMESS-UK1. Using Molden

• Molden reads data from the GAMESS-UK output file

  • read output (loads basis, vectors etc)
    • Molden ? read
  • optimised structure
    • Displayed by default
  • calculating and display orbitals
    • Molden ? dens. Mode ? orbital
  • frequencies
    • change the input to use RUNTYPE FORCE
    • run the calculation, read the output
    • Molden ? Norm. Mode

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