11 dependents
| Package | Description | Downloads/month |
|---|---|---|
| GPU extensions for PySCF | 6K | |
| GPU extensions for PySCF | 2K | |
| 2K | ||
| python implementation of the Freezing String Method | 1K | |
| GPU extensions for PySCF | 694 | |
| Electrostatic Map Suite - A Comprehensive Set of Calculators for Qualifying and ... | 484 | |
| A SEAMM plug-in for calculating energy profiles along coordinates | 386 | |
| geomeTRIC connector for SEAMM | 286 | |
| 276 | ||
| OF-DFT using machine learning | 125 | |
| Atomic and Molecular Cluster Energy Surface Sampler | 107 |
