Mold: a LAMMPS package to compute interfacial free energies and nucleation rates

C++ Submitted 20 October 2023 • Published 26 March 2024
Software repository Paper review Download paper Software archive
Review

Editor: @lucydot (all papers)
Reviewers: @mattwthompson (all reviews), @marjanalbooyeh (all reviews)

Authors

Andres R. Tejedor (0000-0002-9437-6169), Ignacio Sanchez-Burgos (0000-0002-1160-3945), Eduardo Sanz (0000-0001-6474-5835), Carlos Vega (0000-0002-2417-9645), Felipe J. Blas (0000-0001-9030-040X), Ruslan L. Davidchack (0000-0001-9418-5322), Nicodemo Di Pasquale (0000-0001-5676-8527), Jorge Ramirez (0000-0002-8946-3786), Jorge R. Espinosa (0000-0001-9530-2658)

Citation

Tejedor et al., (2024). Mold: a LAMMPS package to compute interfacial free energies and nucleation rates. Journal of Open Source Software, 9(95), 6083, https://doi.org/10.21105/joss.06083

@article{Tejedor2024, doi = {10.21105/joss.06083}, url = {https://doi.org/10.21105/joss.06083}, year = {2024}, publisher = {The Open Journal}, volume = {9}, number = {95}, pages = {6083}, author = {Andres R. Tejedor and Ignacio Sanchez-Burgos and Eduardo Sanz and Carlos Vega and Felipe J. Blas and Ruslan L. Davidchack and Nicodemo Di Pasquale and Jorge Ramirez and Jorge R. Espinosa}, title = {Mold: a LAMMPS package to compute interfacial free energies and nucleation rates}, journal = {Journal of Open Source Software} }
Copy citation string · Copy BibTeX  
Tags

LAMMPS Molecular simulations Phase Transitions Nucleation theory

Altmetrics
Markdown badge

 

License

Authors of JOSS papers retain copyright.

This work is licensed under a Creative Commons Attribution 4.0 International License.

Creative Commons License

Journal of Open Source Software is an affiliate of the Open Source Initiative.

Journal of Open Source Software is part of Open Journals, which is a NumFOCUS-sponsored project.

Table of Contents
Public user content licensed CC BY 4.0 unless otherwise specified.
ISSN 2475-9066