Introduction To Atomistic Simulations

Host University

University of Virginia

Semester

Spring 2025

Course Number

MSE 6270-600

CRN

19686

Discipline

Materials Science and Engineering

Instructor

Leonid Zhigilei

Times and Days

Asynchronous

Course Information

Introduction to several classical atomic-level simulation techniques (molecular dynamics, Metropolis and kinetic Monte Carlo). The basic concepts, capabilities and limitations of the methods are discussed, an overview of the current state-of-the-art is provided, and examples of recent success stories are considered. The emphasis of the course is on getting practical experience in designing and performing computer simulations.