6 projects
calphy
free energy calculation for python
tensorpotential
Graph Atomic Cluster Expansion (GRACE)
amstools
Atomistic Modelling and Simulation tools for material properties by AMS department of ICAMS, Ruhr Univerisity Bochum
python-ace
Python bindings, utilities for PACE and fitting code "pacemaker"
pyace-lite
Python bindings, utilities for PACE and fitting code "pacemaker"
structdbrest
REST API interface to atomistictools.org website
