QE tutorial 6 | How to Choose the Right Pseudopotential in Quantum ESPRESSO
34:31
YouTubeHigher Physics By Sanskar Mishra
QE tutorial 6 | How to Choose the Right Pseudopotential in Quantum ESPRESSO
In this video, I explain how to select a suitable pseudopotential for Quantum ESPRESSO while working on Ubuntu Linux. Choosing the correct pseudopotential is a crucial step in DFT calculations, as it directly affects the accuracy and reliability of results such as band structure, DOS, total energy, and structural properties.
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