Published February 10, 2025
| Version v1
Software
Open
BondPotentials
Description
Code and data to fit Bond Potentials to quantum chemistry data.
Files
BondPotentials-1.1.1.zip
Files
(1.1 MB)
| Name | Size | Download all |
|---|---|---|
|
md5:8445ebd49453fa2916b03bd7a4314731
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1.1 MB | Preview Download |
Additional details
Funding
- Swedish Research Council
- Quantitative Molecular Simulation 2020-05059
- Swedish Research Council
- Machine Learning Physics-Based Chemical Models 2024-04314
Software
- Repository URL
- https://github.com/AlexandriaChemistry/BondPotentials
- Programming language
- Python
- Development Status
- Active