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Contribution

ICTP - Adriatico Guest House - INFOLab (Lower Level 1)

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

Speakers

  • S. BARONI

Organizers

Stefano Baroni (SISSA), Matteo Cococcioni (EPFL), Stefano de Gironcoli (SISSA), Andrea Ferretti (CNR-NANO), Paolo Giannozzi (University of Udine), Nicola Marzari (EPFL), Local Organisers: Ralph Gebauer, Ivan Girotto

Co-sponsors