CITATION.cff

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# ./update-codemeta.sh and commit the regenerated file as well.
cff-version: 1.2.0
message: "If you use this software, please cite it using these metadata."
title: "LAMMPS-GUI"
abstract: >-
  LAMMPS-GUI is a cross-platform Qt-based graphical application for the
  LAMMPS molecular dynamics simulation software. It integrates an
  input-script editor, live simulation execution via the LAMMPS C-library
  interface, log and thermodynamic-data viewing, interactive plotting, and
  snapshot/slide-show visualization into a single tool aimed at learning and
  exploring molecular dynamics with LAMMPS.
type: software
authors:
  - family-names: Kohlmeyer
    given-names: Axel
    orcid: "https://orcid.org/0000-0001-6204-6475"
    affiliation: "Institute for Computational Molecular Science, Temple University, Philadelphia, PA, USA"
version: "3.0.6"
date-released: "2026-07-20"
license: GPL-2.0-or-later
repository-code: "https://github.com/akohlmey/lammps-gui"
url: "https://lammps-gui.lammps.org/"
keywords:
  - molecular dynamics
  - LAMMPS
  - Qt
  - scientific visualization
  - simulation
  - research software
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