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    Computational Materials Science

    43 курсов
    Advanced Quantum ESPRESSO Tutorial: Hubbard and Koopmans Functionals - Day 2 Discussion
    Materials Cloud

    Advanced Quantum ESPRESSO Tutorial: Hubbard and Koopmans Functionals - Day 2 Discussion

    Advanced Quantum ESPRESSO School: Hubbard and Koopmans Functionals - Lecture 1.1
    Materials Cloud

    Advanced Quantum ESPRESSO School: Hubbard and Koopmans Functionals - Lecture 1.1

    AiiDA Tutorial - The Plugin Ecosystem
    Materials Cloud

    AiiDA Tutorial - The Plugin Ecosystem

    First-Principles Calculation of Hubbard Parameters Using Linear-Response Theory - Tutorial 2022
    Materials Cloud

    First-Principles Calculation of Hubbard Parameters Using Linear-Response Theory - Tutorial 2022

    Introduction to Density-Functional Theory - QE School 2023 Lecture 1.2
    Materials Cloud

    Introduction to Density-Functional Theory - QE School 2023 Lecture 1.2

    First-Principles Calculation of Hubbard Parameters Using Linear-Response Theory - QE School 2023
    Materials Cloud

    First-Principles Calculation of Hubbard Parameters Using Linear-Response Theory - QE School 2023

    Phonons and Electron-Phonon Coupling Using DFPT+U - QE School 2023 Lecture 3.5
    Materials Cloud

    Phonons and Electron-Phonon Coupling Using DFPT+U - QE School 2023 Lecture 3.5

    Koopmans Compliance: Towards a Functional Theory of the Spectral Density - Lecture 4.2
    Materials Cloud

    Koopmans Compliance: Towards a Functional Theory of the Spectral Density - Lecture 4.2

    Koopmans Functionals in Practice: Minimisation and Screening Coefficients - Lecture 4.3
    Materials Cloud

    Koopmans Functionals in Practice: Minimisation and Screening Coefficients - Lecture 4.3

    Koopmans Functionals: Basic Concepts - QE School 2023 - Lecture 4.1
    Materials Cloud

    Koopmans Functionals: Basic Concepts - QE School 2023 - Lecture 4.1

    Koopmans Spectral Functionals: Implementation in Periodic Boundary Conditions - QE School 2023
    Materials Cloud

    Koopmans Spectral Functionals: Implementation in Periodic Boundary Conditions - QE School 2023

    Foundation Models for Materials Discovery
    MICDE University of Michigan

    Foundation Models for Materials Discovery

    Computationally Guided Control of Carriers in Semiconductors - Density Functional Theory and Phase-Boundary Mapping for Thermoelectrics
    ICTP-SAIFR

    Computationally Guided Control of Carriers in Semiconductors - Density Functional Theory and Phase-Boundary Mapping for Thermoelectrics

    An Efficient and Accurate Approach to Strongly Correlated Materials
    MuST Program for Disordered Materials

    An Efficient and Accurate Approach to Strongly Correlated Materials

    Electronic and Optical Spectra from Optimally-Tuned Functionals - QE Tutorial 2022
    Materials Cloud

    Electronic and Optical Spectra from Optimally-Tuned Functionals - QE Tutorial 2022

    Exchange-Correlation Functionals of Density Functional Theory - QE School 2023 Lecture 1.3
    Materials Cloud

    Exchange-Correlation Functionals of Density Functional Theory - QE School 2023 Lecture 1.3

    Beyond Harmonic Phonons: Phase Diagrams and Phase Transitions - QE School 2023 Lecture 2.3
    Materials Cloud

    Beyond Harmonic Phonons: Phase Diagrams and Phase Transitions - QE School 2023 Lecture 2.3

    Density-Functional Perturbation Theory: Phonons - Lecture 2.1
    Materials Cloud

    Density-Functional Perturbation Theory: Phonons - Lecture 2.1

    Successes and Failures of DFT+U in Ferroic Materials - Lecture 3.4
    Materials Cloud

    Successes and Failures of DFT+U in Ferroic Materials - Lecture 3.4

    Ab Initio Many-Body Perturbation Theory - QE School 2023 Lecture 4.5
    Materials Cloud

    Ab Initio Many-Body Perturbation Theory - QE School 2023 Lecture 4.5

    AiiDA-Vibroscopy: All-Functional Infrared and Raman Spectra - Lecture 5.2
    Materials Cloud

    AiiDA-Vibroscopy: All-Functional Infrared and Raman Spectra - Lecture 5.2