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What is Quantum Espresso Tutorial: PDOS & Charge Density about?

This document provides a hands-on tutorial for post-processing calculations using the Quantum ESPRESSO package, including tutorials for calculating the density of states, projected density of states, charge density, and STM image simulations of various materials like bulk Ni and Si. The tutorials demonstrate how to run SCF and non-SCF calculations to obtain electronic structure data and then post-process that data to produce useful outputs like the DOS, PDOS, charge density plots, and simulated STM images.

Author

Antonio Rojas

Language

EN