Teaching and Learning with the MIT Atomic Scale Modeling Toolkit - Classical and Quantum Atomic Modeling
Offered By: nanohubtechtalks via YouTube
Course Description
Overview
Save Big on Coursera Plus. 7,000+ courses at $160 off. Limited Time Only!
Explore practical applications of the MIT Atomic-Scale Modeling Toolkit in this comprehensive 59-minute webinar led by Dr. Enrique Guerrero from the University of California, Merced. Dive into live demonstrations of classical and quantum mechanical simulation modules, including molecular dynamics computations using LAMMPS, simple Monte Carlo simulations with the Ising model, and quantum chemistry and density functional theory computations. Learn how to compute phonons and Raman spectra using density functional perturbation theory. Discover pathways to implement this toolkit in various classroom settings, such as computational chemistry, materials physics, solid state physics, or statistical physics. Focus on the practical use of the tool across a broad range of modules, familiarizing yourself with its capabilities. The webinar covers topics like getting started with the toolkit, classical molecular dynamics with Lennard-Jones potentials, carbon nanostructures, revisiting ESPRESSO for phonon calculations, and classical Monte Carlo simulations.
Syllabus
MIT Atomic Scale Toolkit
Previously…C.U.R.E
Previously… Quantum ESPRESSO with MIT Atomic Scale Toolkit
Getting Started
II Getting Started
III Classical Molecular Dynamics: Lennard-Jones
IV Carbon Nanostructures
V Revisiting ESPRESSO: Phonons
VI Classical Monte Carlo
Taught by
nanohubtechtalks
Related Courses
General Chemistry I: Atoms, Molecules, and BondingMassachusetts Institute of Technology via edX The Quantum World
Harvard University via edX Applied Quantum Computing III: Algorithm and Software
Purdue University via edX The Quantum Internet and Quantum Computers: How Will They Change the World?
Delft University of Technology via edX Quantum Mechanics
University of Colorado Boulder via Coursera