Judgement of Energy DIstribution =============================
JEDI is a quantum chemical strain analysis tool working with the Atomic Simulation Environment (ASE).
- Python 3.8 or later
- NumPy (base N-dimensional array package)
- ase 3.23 (functions to determine atomic structures' geometries and quantum chemical calculators)
Add ~/jedi to your $PYTHONPATH environment variable
A tutorial is available here: https://neudecker-group.github.io/jedi/