lammpsio: Transparent and reproducible handling of LAMMPS particle data in Python

Python Submitted 19 July 2025Published 21 December 2025
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Editor: @rkurchin (all papers)
Reviewers: @mhlbapat (all reviews), @Ladme (all reviews)

Authors

C. Levi Petix (0000-0002-0483-7495), Mayukh Kundu (0000-0001-7539-8920), Michael P. Howard (0000-0002-9561-4165)

Citation

Petix et al., (2025). lammpsio: Transparent and reproducible handling of LAMMPS particle data in Python. Journal of Open Source Software, 10(116), 8962, https://doi.org/10.21105/joss.08962

@article{Petix2025, doi = {10.21105/joss.08962}, url = {https://doi.org/10.21105/joss.08962}, year = {2025}, publisher = {The Open Journal}, volume = {10}, number = {116}, pages = {8962}, author = {Petix, C. Levi and Kundu, Mayukh and Howard, Michael P.}, title = {lammpsio: Transparent and reproducible handling of LAMMPS particle data in Python}, journal = {Journal of Open Source Software} }
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LAMMPS molecular dynamics simulation data GSD

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