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Tag: plotting

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Plotting molecular electrostatic potential surfaces (MEPS) with ORCA
  • Notekeeping
  • ORCA

Plotting molecular electrostatic potential surfaces (MEPS) with ORCA

  • Henrique C. S. Junior
  • March 17, 2022
  • 1

The orca_vpot program calculates the electrostatic potential for a set of points provided by the user. But it can be boring or hard. here is how you can do it.

Non-Interactive plotting using orca_plot
  • Notekeeping
  • ORCA

Non-Interactive plotting using orca_plot

  • Henrique C. S. Junior
  • March 17, 2022
  • 0

ORCA provides a convenient way to plot orbitals and densities in the form of a small binary called orca_plot. Here is how to use it more conveniently.

  • Notekeeping
  • ORCA
  • Paper
  • Quantum Mechanics

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