Basic tutorial

This tutorial serves as a hands-on introduction to icet and provides an overview of its key features.

The scripts and database that are required for this tutorial can be downloaded as a single zip archive.

Building a cluster expansion

The first part of this tutorial concerns constructing, validating, and analyzing a cluster expansion.

Sampling a cluster expansion

The second part of this tutorial addresses sampling the cluster expansion constructed above using Monte Carlo simulations and the analysis of these results.