himatcal
Some scripts to perform material simulation.
[!WARNING] 🚧 This repository is still under construction. 🚧
Installation
This project uses uv for dependency management. To install the package and its dependencies:
-
First, ensure you have uv installed:
curl -LsSf https://astral.sh/uv/install.sh | sh
-
Clone the repository and install dependencies:
git clone https://github.com/CCSun21/himatcal.git cd himatcal uv pip install -e .
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To create and activate a virtual environment:
uv venv source .venv/bin/activate # On Unix/macOS # or .venv\Scripts\activate # On Windows
Optional dependencies are organized into extras. To install specific extras:
- For molecule-related features:
uv pip install -e ".[molecule]" - For development tools:
uv pip install -e ".[dev]"
1 maintainer
Metadata
1 maintainer
Release files for himatcal 0.1.9
For a detailed explanation of source distributions (sdists) and built distributions (wheels), please see the package formats documentation.
Source distribution (sdist)
| File | Size | Uploaded | Provenance | Actions |
|---|---|---|---|---|
| himatcal-0.1.9.tar.gz | 155.5 kB | Without provenance | Details for himatcal-0.1.9.tar.gz |
Release files / himatcal-0.1.9.tar.gz
| Download URL | himatcal-0.1.9.tar.gz |
|---|---|
| Size | 155.5 kB |
| Tags | Source |
|
SHA-256 checksum How to use checksums |
bf5c6aaca0b1c7fdfa35d924e848fe0dbcec3d42801a9d07e0e95e6d682b13da
|
|
BLAKE2b-256 checksum How to use checksums |
065043f314b1dcdf983a90a9e005310b1ac5614747d6f44dca5269363133c063
|
| Upload date | |
|
Uploaded using Trusted Publishing? What is trusted publishing? |
No |
| Uploaded via |
twine/6.1.0 CPython/3.12.9
|
Security for himatcal 0.1.9
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No provenance found
None of the files in this release were uploaded with provenance metadata.
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