A small molecular magnetism related package.
Project description
SlothPy is a comprehensive package for computational molecular magnetism.
- Website: your-website
- Documentation: link-to-docs
- E-mail the author: your-mailing-list
- PyPI: PyPI Repository
- Source code: GitHub
- Bug reports: GitHub Issues
- Requests GitHub Pull Requests
SlothPy
SlothPy aims to become a comprehensive software package for computational molecular magnetism. It is designed to provide flexible, interactive computing environment for researchers in the field.
Features
- Interactive scripting via Jupyter Notebooks or terminal.
- Customizable workflows with JIT compilation and parallelism for performance.
- Extensible to integrate with MOLCAS, ORCA, and other chemistry software.
- Visual tools for data analysis and interpretation.
Installation
pip install slothpy
For detailed installation instructions, please refer to the Installation Guide.
Usage
Start with importing SlothPy:
import slothpy as slt
and see your How to Start for various tutorials.
Documentation
For comprehensive guides and tutorials, visit our documentation.
How to Cite
If you use SlothPy in your research, please cite it as follows:
Authors. (Year). "Title of the Paper." Journal Name, Volume(Issue), pages. DOI: DOI Number
Contributing
We welcome contributions in the form of issue reports, pull requests and suggestions send directly via e-mail. Please see our About section.
License
SlothPy is distributed under the GPL-3.0 license. See the LICENSE file for more information.
Contact
For questions and feedback, please contact mikolaj.zychowicz@uj.edu.pl.
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