Vacancy Formation Energy with MD

By Sam Reeve1; Alejandro Strachan1

1. Purdue University

Calculate vacancy formation energy with molecular dynamics and various atomic interaction models

Launch Tool

You must login before you can run this tool.

Version 1.1.1 - published on 03 Aug 2017

doi:10.4231/D34746T4G cite this

Open source: license | download

View All Supporting Documents