| Name | raspa-ase JSON |
| Version |
0.0.1
JSON |
| download |
| home_page | |
| Summary | An ASE calculator for the RASPA molecular simulation package. |
| upload_time | 2024-02-27 02:52:14 |
| maintainer | |
| docs_url | None |
| author | |
| requires_python | <3.13,>=3.9 |
| license | BSD-3 |
| keywords |
raspa
ase
molecular simulations
monte carlo
|
| VCS |
|
| bugtrack_url |
|
| requirements |
No requirements were recorded.
|
| Travis-CI |
No Travis.
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| coveralls test coverage |
No coveralls.
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# raspa_ase
[](https://codecov.io/gh/Quantum-Accelerators/raspa_ase)
[](https://app.deepsource.com/gh/Quantum-Accelerators/raspa_ase/)
An Atomic Simulation Environment (ASE) calculator for the [RASPA](https://github.com/iRASPA/RASPA2) molecular simulation code.
## Documentation 📖
<p align="center">
<a href="https://quantum-accelerators.github.io/raspa_ase/"><b><i>Learn More Here!</i></b></a>
</p>
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