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Authors
Peter R. Spackman (0000-0002-6532-8571)
Citation
Spackman, P. R., (2026). Open Computational Chemistry (OCC) - A portable software library and program for quantum chemistry and crystallography. Journal of Open Source Software, 11(117), 9609, https://doi.org/10.21105/joss.09609
@article{Spackman2026,
doi = {10.21105/joss.09609},
url = {https://doi.org/10.21105/joss.09609},
year = {2026},
publisher = {The Open Journal},
volume = {11},
number = {117},
pages = {9609},
author = {Spackman, Peter R.},
title = {Open Computational Chemistry (OCC) - A portable software library and program for quantum chemistry and crystallography},
journal = {Journal of Open Source Software}
}
Tags
Python WebAssembly quantum chemistry crystallography density functional theory crystal growth
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