Welcome to the documentation for the Interaction EDA SEAMM plug-in
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The Interaction EDA step splits the interaction energy between the molecules of a
cluster into physically meaningful terms -- electrostatics, Pauli repulsion,
dispersion, polarization and charge transfer -- with an energy decomposition analysis
(EDA). It computes the whole cluster and its pairs (and optionally triples), and
separates each term into its 2-body and many-body parts. The first release uses
second-generation ALMO-EDA in GPU4PySCF, on a GPU.

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   .. grid-item-card:: Getting Started
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      A simple introduction

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         To the Getting Started Guide

   .. grid-item-card::  User Guide
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      A complete guide to using this step

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         To the User Guide

   .. grid-item-card::  Developer Guide
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      Contributing to the code. Fixing bugs, adding functionality

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         To the Developer Guide

   .. grid-item-card:: API Reference
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      The API for the Interaction EDA step

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	 To the API Reference.


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   getting_started/index
   user_guide/index
   developer_guide/index
   api/index

More Information
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   authors
   history

   Main SEAMM documentation <https://molssi-seamm.github.io>