Modeling of P-N Junction Devices for Photovoltaic Applications
Explore P-N junction device modeling for photovoltaics using ADEPT, Quantum ESPRESSO, and S4. Learn to simulate various materials and structures, calculate properties, and optimize solar cell designs.
Density Functional Theory: Introduction and Applications
Explore Density Functional Theory fundamentals and applications using Quantum Espresso on nanoHUB. Learn to compute electronic structures, densities of state, total energies, and bulk modulus for materials.
Condensed Matter Physics Class and Research Experience with MIT Atomic-Scale Modeling Toolkit
Explore condensed matter physics through simulations and research experiences using the MIT Atomic-Scale Modeling Toolkit. Learn about covalent bonding, bandstructure, phonons, and magnetic phase transitions.
Interactive Modeling of Materials with DFT Using Quantum ESPRESSO - MIT Atomic Scale Toolkit
Explore interactive modeling of materials using density functional theory with Quantum ESPRESSO in the MIT Atomic-Scale Modeling Toolkit. Learn to compute and analyze various material properties through hands-on examples.
Iron Oxides and Silicates at Extreme Conditions - Advanced Quantum ESPRESSO Tutorial 2022
Explore iron oxides and silicates under extreme conditions, focusing on spin transitions and their impact on Earth's lower mantle seismology and dynamics.
QE Tutorial 2022 - Design of Auxiliary Systems and Connectors for Spectroscopy
Explore advanced quantum mechanics concepts, focusing on Hubbard and Koopmans functionals in linear response, with emphasis on auxiliary systems and spectroscopy design.
Spectral Properties of Finite and Extended Systems Using the KCW Code - QE Tutorial 2022
Explore spectral properties of finite and extended systems using KCW code in Quantum ESPRESSO, focusing on Hubbard and Koopmans functionals.
KCW: Implementation of Koopmans Functionals Based on DFPT - Advanced Quantum ESPRESSO Tutorial 2022
Explore Koopmans functionals implementation in Quantum ESPRESSO using density functional perturbation theory, enhancing electronic structure calculations.
QE Tutorial 2022 - Spectral Properties of Finite and Extended Systems
Explore spectral properties of finite and extended systems through hands-on exercises using Quantum ESPRESSO, focusing on Hubbard and Koopmans functionals.
Accelerating the Calculation of Koopmans Screening Parameters Using Machine Learning
Accelerate Koopmans screening parameter calculations with machine learning techniques in Quantum ESPRESSO, enhancing efficiency in computational materials science.
Koopmans Functionals in Practice - QE Tutorial 2022
Explore Koopmans functionals in Quantum ESPRESSO, focusing on practical applications and advanced techniques for electronic structure calculations.
Koopmans Functionals and Spectral Potential in Quantum ESPRESSO - Tutorial 2
Explore Koopmans functionals in quantum mechanics, focusing on spectral potential connections and applications in materials science.
QE Tutorial 2022 - First-Principles Calculation of Hubbard Parameters
Explore first-principles Hubbard parameter calculations in quantum materials, focusing on chromium oxide and practical applications in advanced quantum simulations.
Phonons and Electron-Phonon Coupling Using DFPT+U - Advanced Quantum ESPRESSO Tutorial
Explore phonons and electron-phonon coupling using DFPT+U in Quantum ESPRESSO, focusing on advanced techniques for Hubbard and Koopmans functionals.
DFT+U and DFT+U+V: How Does It Work? - Hands-on Tutorial
Explore DFT+U and DFT+U+V methodologies in Quantum ESPRESSO through hands-on exercises, enhancing understanding of Hubbard-corrected density functional theory.
Accelerating the Calculation of Hubbard Parameters Using Machine Learning - QE Tutorial 2022
Learn advanced techniques for accelerating Hubbard parameter calculations in Quantum ESPRESSO using machine learning, with a focus on linear response methods and transferability.
Managing High-Throughput Workflows with AiiDA - Advanced Quantum ESPRESSO Tutorial
Explore managing high-throughput workflows with AiiDA for advanced Quantum ESPRESSO calculations, focusing on Hubbard and Koopmans functionals from linear response.
QE Tutorial 2022 - Materials Cloud and AiiDAlab
Explore Materials Cloud and AiiDAlab for advanced quantum calculations in this tutorial on Hubbard and Koopmans functionals from linear response.
Advanced Quantum ESPRESSO Tutorial: Hubbard and Koopmans Functionals - Day 2 Discussion
Explore advanced Quantum ESPRESSO concepts: Hubbard and Koopmans functionals from linear response in this in-depth tutorial discussion.
Advanced Quantum ESPRESSO School: Hubbard and Koopmans Functionals - Lecture 1.1
Explore advanced Quantum ESPRESSO concepts: Hubbard and Koopmans functionals from linear response in this comprehensive lecture.
DFT+U and DFT+U+V: Basic Concepts and Applications - Advanced Quantum ESPRESSO Tutorial 2022
Explore DFT+U and DFT+U+V concepts, applications in materials science, and their impact on electronic localization and energetics in various systems.