DFT fundamentals: from theory to practice.
Hohenberg-Kohn-Sham theory; variational principle; Hellman-Feynman theorem and energy derivatives

Stefano Baroni

Recorded 16 January 2017 in Lausanne, Vaud, Switzerland

Course: High-Performance & High-Throughput Materials Simulations using Quantum ESPRESSO and AiiDA - ICTP Trieste, Jan 2017

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