ParAMS: Train your own ML, DFTB, ReaxFF
***************************************

Here are basic examples for training ReaxFF, DFTB, and ML potentials
with ParAMS.


Getting Started with ParAMS
^^^^^^^^^^^^^^^^^^^^^^^^^^^

* Run a ParAMSJob for Lennard-Jones

* Import ParAMS Training Data with ResultsImporter


ML Potentials
^^^^^^^^^^^^^

* Train an M3GNet Potential with ParAMS

* ML Training with PES Scans and Geometry Optimizations


DFTB, GFN1-xTB
^^^^^^^^^^^^^^

* ParAMS for DFTB: Silicon Band Structure


ParAMS Technical Examples
^^^^^^^^^^^^^^^^^^^^^^^^^

* Set Up ParAMSJob Settings

* Convert Between ParAMS and ASE Formats

See also: Benchmarks
