deb_control_files:
- control
- md5sums
- postinst
- prerm
deb_fields:
Architecture: amd64
Depends: python3 (<< 3.13), python3 (>= 3.12~), python3-joblib (>= 1~), python3-matplotlib
(>= 3.8~), python3-monty (>= 2024.7.29~), python3-networkx (>= 3~), python3-numpy
(>= 1:1.25.0), python3-numpy-abi9, python3-palettable (>= 3.3.3~), python3-pandas
(>= 2~), python3-plotly (>= 4.5.0~), python3-pybtex (>= 0.24.0~), python3-requests
(>= 2.32~), python3-ruamel.yaml (>= 0.17.0~), python3-scipy (>= 1.13.0~), python3-spglib
(>= 2.5.0~), python3-sympy (>= 1.6.2~), python3-tabulate (>= 0.9~), python3-tqdm
(>= 4.60~), python3-uncertainties (>= 3.1.4~), python3:any, libc6 (>= 2.14)
Description: |-
Python Materials Genomics for materials analysis
Pymatgen (Python Materials Genomics) is a robust, open-source Python
library for materials analysis. These are some of the main features:
.
1.Highly flexible classes for the representation of Element, Site,
Molecule, Structure objects.
.
2. Extensive input/output support, including support for VASP
(http://cms.mpi.univie.ac.at/vasp/), ABINIT (http://www.abinit.org/),
CIF, Gaussian, XYZ, and many other file formats.
.
3. Powerful analysis tools, including generation of phase diagrams,
Pourbaix diagrams, diffusion analyses, reactions, etc.
.
4. Electronic structure analyses, such as density of states and band
structure.
.
5. Integration with the Materials Project REST API, Crystallography
Open Database.
.
This package provides the pymtgen module for Python 3.
Homepage: https://pymatgen.org/
Installed-Size: '18035'
Maintainer: Debichem Team <debichem-devel@lists.alioth.debian.org>
Package: python3-pymatgen
Priority: optional
Recommends: python3-openbabel, python3-ase (>= 3.23.0~), python3-vtk9 | python3-paraview
Section: python
Source: pymatgen
Suggests: python-pymatgen-doc, python3-mp-api (>= 0.27.3~)
Version: 2024.10.29+dfsg1-3
srcpkg_name: pymatgen
srcpkg_version: 2024.10.29+dfsg1-3