Review: pymatgen-core-test-files 2026.4.7-1
Package Information
| Description | Python Materials Genomics for materials analysis (test files) 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 test files used by pymatgen-core tests. |
|---|---|
| Maintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
| Changed By | Drew Parsons <dparsons@debian.org> |
| Sponsor | dparsons@debian.org |
| Distribution | unstable |
| Architecture | all |
| VCS | git: https://salsa.debian.org/debichem-team/pymatgen-core-test-files.git (browse) |
| Tracker | https://tracker.debian.org/pkg/pymatgen-core-test-files |
| Uploaded | 4 hours ago |
New Package Report
.changes
| Distribution | unstable |
|---|---|
| Date | Wed, 15 Apr 2026 00:52:12 +0200 |
| Source | pymatgen-core-test-files |
| Version | 2026.4.7-1 |
| Changed-By | Drew Parsons |
| Architecture | source all |
Changelog
pymatgen-core-test-files (2026.4.7-1) unstable; urgency=medium
.
* initial debianisation. Supports pymatgen-core (ITP#1132990)
by separating out test files from upstream source.dsc
| Priority | optional |
|---|---|
| Component | main |
| Package-List | pymatgen-core-test-files deb python optional arch=all |
| Section | python |
debian/copyright
Format: https://www.debian.org/doc/packaging-manuals/copyright-format/1.0/
Upstream-Name: pymatgen
Upstream-Contact: Shyue Ping Ong <ongsp@eng.ucsd.edu>
Source: https://github.com/materialsproject/pymatgen-core
Files-Excluded: test-files/cif/PF_sd*.cif
dev_scripts
docs
src/pymatgen
tasks.py
pyproject.toml
requirements*txt
setup.py
uv.lock
Files: *
Copyright: 2011-2026 Shyue Ping Ong <ongsp@eng.ucsd.edu>
and the Pymatgen Development Team.
2011-2012 MIT & The Regents of the University of California, through Lawrence Berkeley National Laboratory
2026 Materialyze.AI
License: MIT
Files: test-files/cif/C26H16BeN2O2S2.cif
Copyright: 2005 Yi-Ping Tong, Shao-Liang Zheng, Xiao-Ming Chen
License: COD-CC0
Comment:
This file is available in the Crystallography Open Database (COD),
http://www.crystallography.net/. The original data for this entry
were provided the Crystal Eye server at
http://wwmm.ch.cam.ac.uk/crystaleye/, created by Nick Day at the
Peter Murray-Rust laboratory.
.
The file may be used within the scientific community so long as
proper attribution is given to the journal article from which the
data were obtained:
.
Syntheses, Structures, Photoluminescence, and Theoretical Studies of
a Class of Beryllium(II) Compounds of Aromatic N,O-Chelate Ligands
Yi-Ping Tong, Shao-Liang Zheng, and Xiao-Ming Chen
Inorganic Chemistry 2005 44 (12), 4270-4275
DOI: 10.1021/ic0501059
Files: debian/*
Copyright: 2026 Drew Parsons <dparsons@debian.org>
License: MIT
License: MIT
Permission is hereby granted, free of charge, to any person obtaining
a copy of this software and associated documentation files (the
"Software"), to deal in the Software without restriction, including
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distribute, sublicense, and/or sell copies of the Software, and to
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License: COD-CC0
This file is available in the Crystallography Open Database (COD),
http://www.crystallography.net/. The original data for this entry
were provided the Crystal Eye server at
http://wwmm.ch.cam.ac.uk/crystaleye/, created by Nick Day at the
Peter Murray-Rust laboratory.
.
The file may be used within the scientific community so long as
proper attribution is given to the journal article from which the
data were obtained.
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Review Information
started — allocated to eamanu 2 hours ago, started 2 hours ago.