.. geomeTRIC documentation master file.

GeomeTRIC Documentation for Users and Contributors
==================================================

.. image:: images/geometric-logo.png
   :width: 400

GeomeTRIC is a software package for molecular geometry optimization.
It is also the reference implementation of the translation-rotation internal coordinate system (TRIC).
Main features of geomeTRIC include:

* Energy minimization
* Constrained energy minimization
* Transition state optimization
* Nudged elastic band
* Conical intersection optimization

.. toctree::
   :maxdepth: 2
   :caption: Contents:

   install
   quickstart
   examples
   how-it-works
   constraints
   transition
   neb
   irc
   meci
   engines
   help
   options
   citation
   
Indices and tables
==================

* :ref:`genindex`
* :ref:`modindex`
* :ref:`search`