Density functional theory software
Quantum ESPRESSO is a suite for first-principles electronic-structure calculations and materials modeling, distributed for free and as free software under the GNU General Public License. It is based on density-functional theory, plane wave basis sets, and pseudopotentials (both norm-conserving and ultrasoft). ESPRESSO is an acronym for opEn-Source Package for Research in Electronic Structure, Simulation, and Optimization. The core plane wave DFT functions of QE are provided by the PWscf component (PWscf previously existed as an independent project). PWscf (Plane-Wave Self-Consistent Field) is a set of programs for electronic structure calculations within density functional theory and density functional perturbation theory, using plane wave basis sets and pseudopotentials. The software is released under the GNU General Public License. The latest version QE-7.1 was released on 16 June 2022. (Wikipedia).
Quantum Theory - Full Documentary HD
Check: https://youtu.be/Hs_chZSNL9I The World of Quantum - Full Documentary HD http://www.advexon.com For more Scientific DOCUMENTARIES. Subscribe for more Videos... Quantum mechanics (QM -- also known as quantum physics, or quantum theory) is a branch of physics which deals with physica
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Vikram Gavini - Fast, Accurate and Large-scale Ab-initio Calculations for Materials Modeling
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Stefano Baroni - estimate transport coefficients from short equilibrium molecular-dynamic simulation
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Kieron Burke: "Density functionals from machine learning"
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