sunqm / py-qc-book

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Python for Quantum Chemistry: A Full Stack Programming Guide

Welcome to the repository for the book Python for Quantum Chemistry: A Full Stack Programming Guide. This repository contains all the code examples and supplementary materials in the book.

To run the code examples, make sure to install the required libraries:

pip install -r requirements.txt

Please note that some chapters may have specific dependencies. You can install these dependencies by using the provided requirements.txt file in each chapter.

We welcome your feedback and encourage you to use the issue board to post comments, ask questions, or report any issues you encounter in the book.

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