v1.0.0

Overview

This repository contains the input and some key output files for NA-MD calculations of periodic pentacene systems using the Libra/eQE interface.

What's Changed

• Added the input file and plotting code, the output file took up too m… by @SpringDabao in #1
• Update by @SpringDabao in #2

New Contributors

• @SpringDabao made their first contribution in #1

Full Changelog: https://github.com/AkimovLab/Project_Libra-eQE/commits/v1.0.0