{ "cells": [ { "cell_type": "markdown", "id": "666d3036-47d5-44d2-bc1a-ca4b00a9e9b8", "metadata": {}, "source": [ "# LAMMPS Python Tutorials" ] }, { "cell_type": "markdown", "id": "f1422a43-f76b-456b-bf76-61ad92bd4ff0", "metadata": {}, "source": [ "Author: [Richard Berger](mailto:richard.berger@outlook.com)" ] }, { "cell_type": "markdown", "id": "8f2ea92d-8cc3-4999-81a0-79aa55bb66ab", "metadata": {}, "source": [ "## Contents\n", "\n", "- [Example 1: Using LAMMPS with Python](simple.ipynb)\n", "- [Example 2: Analyzing LAMMPS thermodynamic data](thermo.ipynb)\n", "- [Example 3: Using Atom Data](atoms.ipynb)\n", "- [Example 4: Validating a dihedral potential](dihedrals/dihedral.ipynb)\n", "- [Example 5: Running a Monte Carlo relaxation](montecarlo/mc.ipynb)" ] }, { "cell_type": "code", "execution_count": null, "id": "b41dc533-be6d-4450-8ad7-7345e9f44ea3", "metadata": {}, "outputs": [], "source": [] } ], "metadata": { "kernelspec": { "display_name": "Python 3 (ipykernel)", "language": "python", "name": "python3" }, "language_info": { "codemirror_mode": { "name": "ipython", "version": 3 }, "file_extension": ".py", "mimetype": "text/x-python", "name": "python", "nbconvert_exporter": "python", "pygments_lexer": "ipython3", "version": "3.12.7" } }, "nbformat": 4, "nbformat_minor": 5 }