ce-tutorials
1.0
Overview
Part 1: CE construction
Part 2: Low-symmetry systems
Part 3: MC sampling
ce-tutorials
materialsmodeling.org
Cluster expansion tutorials
ΒΆ
Overview
Part 1: CE construction
Structure enumeration
Random structure generation
Condition number selection of structures
Active learning
Orthogonal structure generation
Cutoff selection
Regression methods
Hyper-parameter scans
Part 2: Low-symmetry systems
CE constructuon for low-symmetry systems
Part 3: MC sampling
Canonical ensemble
SGC and VCSGC ensembles
Additional material