Plotting Molecular Orbitals with Quantum ESPRESSO TUTORIAL

>> YOUR LINK HERE: ___ http://youtube.com/watch?v=FrY8Sj0zUus

In this tutorial I describe the procedure to plot the Molecular Orbitals of a molecule or a crystal structure using the pp.x utility of Quantum ESPRESSO. • Step 1. First perform an scf calculation using the pw.x . • Step 2. Plot MOs using the pp.x utility and entering the following input in standard input using the terminal as shown in video. • • 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: / bragitoff • FB Profile: / ducktape07 • FB Page2: / physwhizforum • IG: / ___physwhiz___ • IG2: / ducktape07 • BLOG: http://bragitoff.com • FORUM: http://physwhiz.bragitoff.com • ANDROID APPS: • CrysX: https://www.bragitoff.com/crysx/ • Others: https://play.google.com/store/apps/de...

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