In this tutorial I show how to plot the Molecular Orbitals generated from softwares such as Gaussian, Quantum ESPRESSO, Turbomole, etc. using JMOL. Use the following commands:
$$ load 'address_of_cub_file'
$$ isosurface sign red blue 'address_of_cub_file'
If you have any questions/doubts/suggestions, leave them in the comment's section down below.
Hope you find it useful!
Follow me on:
FB Page:
FB Profile:
FB Page2:
IG:
IG2:
BLOG:
FORUM:
ANDROID APPS:
CrysX:
Others:

0 Comments