A Practical Introduction to Density Functional Theory

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English

First online date2020-11-20

Abstract

These lecture notes contain a brief practical introduction to doing density functional theory calculations for crystals using the open source Quantum Espresso software. The level is aimed at graduate students who are studying condensed matter or solid state physics, either theoretical or experimental.

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Citation (ISO format)

RADEMAKER, Louk. A Practical Introduction to Density Functional Theory. 2020. doi: 10.48550/arXiv.2011.09888

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Creation13/12/2022 08:38:00

First validation13/12/2022 08:38:00

Update time16/03/2023 10:15:30

Status update16/03/2023 10:15:29

Last indexation01/11/2024 03:45:40