========================== Changelog ========================== All notable changes to this project are documented here. Version 0.1.0 (2025-10-20) =========================== **Initial public release.** **Added** ---------- - Simple MD-simulation with NVE and NPT ensambles with ASE, parsed from yaml-config file. - Simple visualization with ASE. - Command line interface, CLI. - Following calculations can be performed: - Mean square displacement (MSD) - Lindemann melting criterion - Self diffusion coefficient - Isobaric specific heat per atom ---- Older Versions =============== *(No earlier versions.)*