Quantum ESPRESSO schools
- Owner: Roberto Bendinelli
- Created on Nov 28, 2023
Video recordings and educational material from past schools on Quantum ESPRESSO.
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Summer school on Materials Modeling from first principles: theory and practice, ICMR, University of California at Santa Barbara, July 19-31, 2009.
The school covers basic concepts and recent advances and developments. The former include ground-state calculations for isolated molecules and extended systems, pseudopotential theory and plane-wave basis sets, forces, stresses, and geometry and reaction-path optimizations, linear-response theory and phonons, and ab-initio molecular dynamics. Advanced techniques include first-principles vibrational (IR, Raman) and magnetic (EPR, NMR) spectroscopies, electron-phonon and phonon-phonon interactions, excited states (TDDFT and GW), DFT+U and non-collinear magnetism, Wannier functions and quantum transport.[ordering]manual[endordering][collection_order]["68a25dc3e4b021481f6e30e0","68a25d3ee4b021481f6e3024","68a25c0de4b021481f6e2e6a","68a25b79e4b021481f6e2d92","68a25a6ce4b021481f6e2bcf","68a25a05e4b021481f6e2a47","68a25970e4b021481f6e29d7","68a258e8e4b021481f6e28b9","68a257a9e4b021481f6e27fa","68a25703e4b021481f6e277d","68a256c6e4b021481f6e275c","68a2566be4b021481f6e26fd"][endcollection_order]
The school covers basic concepts and recent advances and developments. The former include ground-state calculations for isolated molecules and extended systems, pseudopotential theory and plane-wave basis sets, forces, stresses, and geometry and reaction-path optimizations, linear-response theory and phonons, and ab-initio molecular dynamics. Advanced techniques include first-principles vibrational (IR, Raman) and magnetic (EPR, NMR) spectroscopies, electron-phonon and phonon-phonon interactions, excited states (TDDFT and GW), DFT+U and non-collinear magnetism, Wannier functions and quantum transport.[ordering]manual[endordering][collection_order]["68a25dc3e4b021481f6e30e0","68a25d3ee4b021481f6e3024","68a25c0de4b021481f6e2e6a","68a25b79e4b021481f6e2d92","68a25a6ce4b021481f6e2bcf","68a25a05e4b021481f6e2a47","68a25970e4b021481f6e29d7","68a258e8e4b021481f6e28b9","68a257a9e4b021481f6e27fa","68a25703e4b021481f6e277d","68a256c6e4b021481f6e275c","68a2566be4b021481f6e26fd"][endcollection_order]
Owner: Roberto Bendinelli
Created on Aug 04, 2025
Advanced Workshop on High-Performance & High-Throughput Materials Simulations using Quantum ESPRESSO | (smr 3102), Trieste, January 16 - 31, 2017.
Owner: Roberto Bendinelli
Created on Dec 18, 2023
Advanced Quantum ESPRESSO tutorial: Hubbard and Koopmans functionals from linear response - Virtual tutorial, November 9-11, 2022
https://sites.google.com/view/hubbard-koopmans[ordering]manual[endordering]
https://sites.google.com/view/hubbard-koopmans[ordering]manual[endordering]
Owner: Roberto Bendinelli
Created on Nov 28, 2023
Advanced Quantum ESPRESSO school: Hubbard and Koopmans functionals from linear response - University of Pavia, August 28 - September 1, 2023
Owner: Roberto Bendinelli
Created on Nov 28, 2023