Metadata-Version: 2.4
Name: multipie
Version: 2.4.0
Summary: A python library for crystallographic symmetry operations and Symmetry-Adapted Multipole Basis (SAMB).
Author-email: Hiroaki Kusunose <hiroaki.kusunose@gmail.com>, Rikuto Oiwa <ro.qp.07@gmail.com>
License-Expression: MPL-2.0
Project-URL: Homepage, https://github.com/CMT-MU/MultiPie
Project-URL: Issues, https://github.com/CMT-MU/MultiPie/issues
Keywords: group theory,condensed matter,materials science,symmetry-adapted basis
Classifier: Intended Audience :: Science/Research
Classifier: Topic :: Scientific/Engineering :: Information Analysis
Classifier: Topic :: Scientific/Engineering :: Physics
Classifier: Topic :: Scientific/Engineering :: Mathematics
Classifier: Operating System :: Microsoft :: Windows
Classifier: Operating System :: POSIX
Classifier: Operating System :: MacOS
Classifier: Programming Language :: Python :: 3.12
Classifier: Programming Language :: Python :: 3.13
Requires-Python: >=3.12
Description-Content-Type: text/markdown
License-File: LICENSE
Requires-Dist: joblib
Requires-Dist: click
Requires-Dist: seekpath>=2.1
Requires-Dist: numpy>=2
Requires-Dist: sympy
Requires-Dist: scipy
Requires-Dist: matplotlib
Requires-Dist: spglib>=2.5
Provides-Extra: tetrahedron
Requires-Dist: libtetrabz; extra == "tetrahedron"
Provides-Extra: dev
Requires-Dist: black; extra == "dev"
Requires-Dist: jupyter-book==1.0.4.post1; extra == "dev"
Requires-Dist: ghp-import; extra == "dev"
Requires-Dist: qtdraw; extra == "dev"
Requires-Dist: pytest; extra == "dev"
Requires-Dist: pytest-xdist; extra == "dev"
Dynamic: license-file

# [MultiPie](https://cmt-mu.github.io/MultiPie/)

A Python library for a database of crystallographic (magnetic) point and space groups, and constructing Symmetry-Adapted Multipole Basis (SAMB).
Molecular or crystal structures and generated SAMB are best drawn by using [QtDraw](https://github.com/CMT-MU/QtDraw).

- **Authors**: Hiroaki Kusunose and Rikuto Oiwa

- **Installation**: MultiPie can be installed from PyPI using pip on Python >= 3.12:
  ```
  pip install multipie
  ```
  You can also visit
  [PyPI](https://pypi.org/project/multipie/) or [GitHub](https://github.com/CMT-MU/MultiPie) to download the source.

- **Requirements**:
  - This library optionally requires [TeXLive](https://www.tug.org/texlive/) environment to create LaTeX and PDF files.
  - Molecular or crystal structure files are optionally generated by [QtDraw](https://github.com/CMT-MU/QtDraw).

- **Citing MultiPie and QtDraw**: If you are using MultiPie and/or QtDraw in your scientific research, please help our scientific visibility by citing our work:
  > Hiroaki Kusunose, Rikuto Oiwa, and Satoru Hayami, Symmetry-adapted modeling for molecules and crystals, Phys. Rev. B <b>107</b>, 195118 (2023).<br>
  > DOI: [https://doi.org/10.1103/PhysRevB.107.195118](https://doi.org/10.1103/PhysRevB.107.195118)

- **License**: MultiPie is distributed under the [Mozilla Public License version 2.0 (MPL v2)](https://mozilla.org/MPL/2.0/).
  Versions up to 2.3.4 were distributed under the MIT License.
