The Examples Suite

Introduction

The ChemShell distribution includes a selection of test cases in the directory examples. These are not primarily intended to explain how to use the code. For this purpose, the reader is referred to the tutorial. However, the examples may cover some functions not described in the tutorial so you may find it useful as guidance for your own input scripts.

The examples are also used to validate that compilation of ChemShell has been successful, as described in the installation notes.