:title: Index

.. image:: _static/logoesipy.png
   :alt: ESIpy Logo
   :align: center

Program aimed at the calculation of population analysis and aromaticity indicators from different Hilbert-space
partitions using the PySCF module.

This program has been developed by Joan Grèbol-Tomàs under the supervision of Eduard Matito and Pedro Salvador.

.. toctree::
   :maxdepth: 3
   :caption: Contents:

   Introduction <intro>
   Installation Guide <installation>
   Theoretical Background <theory>
   Getting started <get-started>
   ESIpy from FCHK <fchk>
   Advanced utilities <advanced>
   MCI Timings <mci-timings>
   API Reference <api>