Packages / Debian 12 (Bookworm) / python / python3-pymatgen

Package: python3-pymatgen (2022.11.7+dfsg1-11+deb12u2)

Python Materials Genomics for materials analysis

Other Packages Related to python3-pymatgen:

dep: [python3] (<< 3.12)
interactive high-level object-oriented language (default python3 version)
dep: [python3] (>= 3.11~)
interactive high-level object-oriented language (default python3 version)
dep: [python3-matplotlib] (>= 1.5~)
Python based plotting system in a style similar to Matlab (Python 3)
dep: [python3-monty] (>= 3.0.2~)
missing complement to Python (Python 3)
dep: [python3-networkx] (>= 2.2~)
tool to create, manipulate and study complex networks (Python3)
dep: [python3-numpy] (>= 1.20.1~)
Fast array facility to the Python 3 language
dep: [python3-palettable] (>= 3.1.1~)
library of color palettes for Python (Python 3)
dep: [python3-pandas] (>= 1.1.3~)
data structures for "relational" or "labeled" data
dep: [python3-plotly] (>= 4.5.0~)
Python 3 plotting library for publication-quality graphs
dep: [python3-pybtex] (>= 0.22.2~)
BibTeX-compatible bibliography processor - Python 3 module
dep: [python3-requests] (>= 2.24.0~)
elegant and simple HTTP library for Python3, built for human beings
dep: [python3-ruamel.yaml] (>= 0.16.12~)
roundtrip YAML parser/emitter (Python 3 module)
dep: [python3-scipy] (>= 1.5.2~)
scientific tools for Python 3
dep: [python3-spglib] (>= 2.0.2~)
C library for crystal symmetry determination - Python3 bindings
dep: [python3-sympy] (>= 1.6.2~)
Computer Algebra System (CAS) in Python (Python 3)
dep: [python3-tabulate] (>= 0.8.7~)
pretty-print tabular data in Python3
dep: [python3-tqdm] (>= 4.41.0~)
fast, extensible progress bar for Python 3 and CLI tool
dep: [python3-uncertainties] (>= 3.1.4~)
Python3 module for calculations with uncertainties
dep: [python3] [any]
interactive high-level object-oriented language (default python3 version)
dep: [libc6] (>= 2.14)
GNU C Library: Shared libraries

rec: [python3-openbabel]
Chemical toolbox library (Python bindings)
rec: [python3-mp-api]
Materials Project API for Python

sug: [python-pymatgen-doc]
Python Materials Genomics for materials analysis (documentation)

Download python3-pymatgen

Architecture	Package size	Installed size	Files	Package
amd64	2.0 MiB	15 MiB	list of files	Download
arm64	1.9 MiB	15 MiB	list of files	Download

Package file paths (443)

Showing the first 250 sorted package-associated paths. Use file search to locate a specific path.

/usr/bin/feff_plot_cross_section
/usr/bin/feff_plot_dos
/usr/bin/gaussian_analyzer
/usr/bin/get_environment
/usr/bin/pmg
/usr/lib/python3/dist-packages/pymatgen-2022.11.7.dist-info/entry_points.txt
/usr/lib/python3/dist-packages/pymatgen-2022.11.7.dist-info/METADATA
/usr/lib/python3/dist-packages/pymatgen-2022.11.7.dist-info/RECORD
/usr/lib/python3/dist-packages/pymatgen-2022.11.7.dist-info/top_level.txt
/usr/lib/python3/dist-packages/pymatgen-2022.11.7.dist-info/WHEEL
/usr/lib/python3/dist-packages/pymatgen/alchemy/filters.py
/usr/lib/python3/dist-packages/pymatgen/alchemy/__init__.py
/usr/lib/python3/dist-packages/pymatgen/alchemy/materials.py
/usr/lib/python3/dist-packages/pymatgen/alchemy/transmuters.py
/usr/lib/python3/dist-packages/pymatgen/analysis/adsorption.py
/usr/lib/python3/dist-packages/pymatgen/analysis/aflow_prototypes.json
/usr/lib/python3/dist-packages/pymatgen/analysis/atomic_subshell_photoionization_cross_sections.csv
/usr/lib/python3/dist-packages/pymatgen/analysis/bond_dissociation.py
/usr/lib/python3/dist-packages/pymatgen/analysis/bonds_jmol_ob.yaml
/usr/lib/python3/dist-packages/pymatgen/analysis/bond_valence.py
/usr/lib/python3/dist-packages/pymatgen/analysis/bvparam_1991.yaml
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/connectivity/connected_components.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/connectivity/connectivity_finder.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/connectivity/environment_nodes.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/connectivity/__init__.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/connectivity/structure_connectivity.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/chemenv_strategies.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/A#2.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/AC#12.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/allcg.txt
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/BO_1#8.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/BO_2#8.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/BO_3#8.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/BS_1#10.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/BS_2#10.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/C#12.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/C#8.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/CO#11.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/DD#20.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/DD#8.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/DDPN#8.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/DI#11.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/ET#7.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/FO#7.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/H#10.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/H#11.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/HA#12.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/HB#8.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/HD#9.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/HP#12.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/I#12.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/__init__.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/L#2.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/MI#10.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/O#6_explicit.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/O#6.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/PA#10.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/PB#7.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/PBP#12.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/PCPA#11.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/PP#10.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/PP#5.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/PP#6.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/S#10.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/S#12.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/S#1.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/S#4.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/S#5.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/SA#8.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/SBSA#10.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/SBT#8.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/SC#12.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/SH#11.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/SH#13.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/SMA#9.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/SS#4.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/SS#9.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/ST#7.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/SY#4.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/T#4.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/T#5.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/T#6.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/TBSA#10.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/TBT#8.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/TC#9.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/TI#9.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/TL#3.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/TO_1#9.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/TO_2#9.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/TO_3#9.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/TS#3.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/TT#12.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/TT_1#9.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/TT_2#9.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/TT_3#9.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries_files/TY#3.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometries.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/coordination_geometry_finder.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/__init__.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/strategy_files/ImprovedConfidenceCutoffDefaultParameters.json
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/structure_environments.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/coordination_environments/voronoi.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/__init__.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/utils/chemenv_config.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/utils/chemenv_errors.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/utils/coordination_geometry_utils.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/utils/defs_utils.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/utils/func_utils.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/utils/graph_utils.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/utils/__init__.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/utils/math_utils.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chemenv/utils/scripts_utils.py
/usr/lib/python3/dist-packages/pymatgen/analysis/chempot_diagram.py
/usr/lib/python3/dist-packages/pymatgen/analysis/cn_opt_params.yaml
/usr/lib/python3/dist-packages/pymatgen/analysis/costdb_elements.csv
/usr/lib/python3/dist-packages/pymatgen/analysis/cost.py
/usr/lib/python3/dist-packages/pymatgen/analysis/diffraction/atomic_scattering_params.json
/usr/lib/python3/dist-packages/pymatgen/analysis/diffraction/core.py
/usr/lib/python3/dist-packages/pymatgen/analysis/diffraction/__init__.py
/usr/lib/python3/dist-packages/pymatgen/analysis/diffraction/neutron.py
/usr/lib/python3/dist-packages/pymatgen/analysis/diffraction/neutron_scattering_length.json
/usr/lib/python3/dist-packages/pymatgen/analysis/diffraction/tem.py
/usr/lib/python3/dist-packages/pymatgen/analysis/diffraction/xrd.py
/usr/lib/python3/dist-packages/pymatgen/analysis/dimensionality.py
/usr/lib/python3/dist-packages/pymatgen/analysis/disorder.py
/usr/lib/python3/dist-packages/pymatgen/analysis/elasticity/elastic.py
/usr/lib/python3/dist-packages/pymatgen/analysis/elasticity/__init__.py
/usr/lib/python3/dist-packages/pymatgen/analysis/elasticity/strain.py
/usr/lib/python3/dist-packages/pymatgen/analysis/elasticity/stress.py
/usr/lib/python3/dist-packages/pymatgen/analysis/energy_models.py
/usr/lib/python3/dist-packages/pymatgen/analysis/eos.py
/usr/lib/python3/dist-packages/pymatgen/analysis/ewald.py
/usr/lib/python3/dist-packages/pymatgen/analysis/excitation.py
/usr/lib/python3/dist-packages/pymatgen/analysis/ferroelectricity/__init__.py
/usr/lib/python3/dist-packages/pymatgen/analysis/ferroelectricity/polarization.py
/usr/lib/python3/dist-packages/pymatgen/analysis/fragmenter.py
/usr/lib/python3/dist-packages/pymatgen/analysis/functional_groups.py
/usr/lib/python3/dist-packages/pymatgen/analysis/gb/grain.py
/usr/lib/python3/dist-packages/pymatgen/analysis/gb/__init__.py
/usr/lib/python3/dist-packages/pymatgen/analysis/graphs.py
/usr/lib/python3/dist-packages/pymatgen/analysis/hhi_data.csv
/usr/lib/python3/dist-packages/pymatgen/analysis/hhi.py
/usr/lib/python3/dist-packages/pymatgen/analysis/icsd_bv.yaml
/usr/lib/python3/dist-packages/pymatgen/analysis/interface.py
/usr/lib/python3/dist-packages/pymatgen/analysis/interface_reactions.py
/usr/lib/python3/dist-packages/pymatgen/analysis/interfaces/coherent_interfaces.py
/usr/lib/python3/dist-packages/pymatgen/analysis/interfaces/__init__.py
/usr/lib/python3/dist-packages/pymatgen/analysis/interfaces/substrate_analyzer.py
/usr/lib/python3/dist-packages/pymatgen/analysis/interfaces/zsl.py
/usr/lib/python3/dist-packages/pymatgen/analysis/ionic_radii.json
/usr/lib/python3/dist-packages/pymatgen/analysis/local_env.py
/usr/lib/python3/dist-packages/pymatgen/analysis/magnetism/analyzer.py
/usr/lib/python3/dist-packages/pymatgen/analysis/magnetism/default_magmoms.yaml
/usr/lib/python3/dist-packages/pymatgen/analysis/magnetism/heisenberg.py
/usr/lib/python3/dist-packages/pymatgen/analysis/magnetism/__init__.py
/usr/lib/python3/dist-packages/pymatgen/analysis/magnetism/jahnteller.py
/usr/lib/python3/dist-packages/pymatgen/analysis/molecule_matcher.py
/usr/lib/python3/dist-packages/pymatgen/analysis/molecule_structure_comparator.py
/usr/lib/python3/dist-packages/pymatgen/analysis/nmr.py
/usr/lib/python3/dist-packages/pymatgen/analysis/op_params.yaml
/usr/lib/python3/dist-packages/pymatgen/analysis/path_finder.py
/usr/lib/python3/dist-packages/pymatgen/analysis/phase_diagram.py
/usr/lib/python3/dist-packages/pymatgen/analysis/piezo.py
/usr/lib/python3/dist-packages/pymatgen/analysis/piezo_sensitivity.py
/usr/lib/python3/dist-packages/pymatgen/analysis/pourbaix_diagram.py
/usr/lib/python3/dist-packages/pymatgen/analysis/prototypes.py
/usr/lib/python3/dist-packages/pymatgen/analysis/quasiharmonic.py
/usr/lib/python3/dist-packages/pymatgen/analysis/reaction_calculator.py
/usr/lib/python3/dist-packages/pymatgen/analysis/solar/am1.5G.dat
/usr/lib/python3/dist-packages/pymatgen/analysis/solar/__init__.py
/usr/lib/python3/dist-packages/pymatgen/analysis/solar/slme.py
/usr/lib/python3/dist-packages/pymatgen/analysis/structure_analyzer.py
/usr/lib/python3/dist-packages/pymatgen/analysis/structure_matcher.py
/usr/lib/python3/dist-packages/pymatgen/analysis/structure_prediction/data/lambda.json
/usr/lib/python3/dist-packages/pymatgen/analysis/structure_prediction/data/pair_correlation.json
/usr/lib/python3/dist-packages/pymatgen/analysis/structure_prediction/DLS_bond_params.yaml
/usr/lib/python3/dist-packages/pymatgen/analysis/structure_prediction/dopant_predictor.py
/usr/lib/python3/dist-packages/pymatgen/analysis/structure_prediction/__init__.py
/usr/lib/python3/dist-packages/pymatgen/analysis/structure_prediction/substitution_probability.py
/usr/lib/python3/dist-packages/pymatgen/analysis/structure_prediction/substitutor.py
/usr/lib/python3/dist-packages/pymatgen/analysis/structure_prediction/volume_predictor.py
/usr/lib/python3/dist-packages/pymatgen/analysis/substrate_analyzer.py
/usr/lib/python3/dist-packages/pymatgen/analysis/surface_analysis.py
/usr/lib/python3/dist-packages/pymatgen/analysis/thermochemistry.py
/usr/lib/python3/dist-packages/pymatgen/analysis/topological/__init__.py
/usr/lib/python3/dist-packages/pymatgen/analysis/topological/spillage.py
/usr/lib/python3/dist-packages/pymatgen/analysis/transition_state.py
/usr/lib/python3/dist-packages/pymatgen/analysis/vesta_cutoffs.yaml
/usr/lib/python3/dist-packages/pymatgen/analysis/wulff.py
/usr/lib/python3/dist-packages/pymatgen/analysis/xas/__init__.py
/usr/lib/python3/dist-packages/pymatgen/analysis/xas/spectrum.py
/usr/lib/python3/dist-packages/pymatgen/analysis/xps.py
/usr/lib/python3/dist-packages/pymatgen/apps/battery/analyzer.py
/usr/lib/python3/dist-packages/pymatgen/apps/battery/battery_abc.py
/usr/lib/python3/dist-packages/pymatgen/apps/battery/conversion_battery.py
/usr/lib/python3/dist-packages/pymatgen/apps/battery/__init__.py
/usr/lib/python3/dist-packages/pymatgen/apps/battery/insertion_battery.py
/usr/lib/python3/dist-packages/pymatgen/apps/battery/plotter.py
/usr/lib/python3/dist-packages/pymatgen/apps/borg/hive.py
/usr/lib/python3/dist-packages/pymatgen/apps/borg/__init__.py
/usr/lib/python3/dist-packages/pymatgen/apps/borg/queen.py
/usr/lib/python3/dist-packages/pymatgen/apps/__init__.py
/usr/lib/python3/dist-packages/pymatgen/cli/feff_plot_cross_section.py
/usr/lib/python3/dist-packages/pymatgen/cli/feff_plot_dos.py
/usr/lib/python3/dist-packages/pymatgen/cli/gaussian_analyzer.py
/usr/lib/python3/dist-packages/pymatgen/cli/get_environment.py
/usr/lib/python3/dist-packages/pymatgen/cli/__init__.py
/usr/lib/python3/dist-packages/pymatgen/cli/pmg_analyze.py
/usr/lib/python3/dist-packages/pymatgen/cli/pmg_config.py
/usr/lib/python3/dist-packages/pymatgen/cli/pmg_plot.py
/usr/lib/python3/dist-packages/pymatgen/cli/pmg_potcar.py
/usr/lib/python3/dist-packages/pymatgen/cli/pmg.py
/usr/lib/python3/dist-packages/pymatgen/cli/pmg_query.py
/usr/lib/python3/dist-packages/pymatgen/cli/pmg_structure.py
/usr/lib/python3/dist-packages/pymatgen/command_line/bader_caller.py
/usr/lib/python3/dist-packages/pymatgen/command_line/chargemol_caller.py
/usr/lib/python3/dist-packages/pymatgen/command_line/critic2_caller.py
/usr/lib/python3/dist-packages/pymatgen/command_line/enumlib_caller.py
/usr/lib/python3/dist-packages/pymatgen/command_line/gulp_caller.py
/usr/lib/python3/dist-packages/pymatgen/command_line/__init__.py
/usr/lib/python3/dist-packages/pymatgen/command_line/mcsqs_caller.py
/usr/lib/python3/dist-packages/pymatgen/command_line/OxideTersoffPotentials
/usr/lib/python3/dist-packages/pymatgen/command_line/vampire_caller.py
/usr/lib/python3/dist-packages/pymatgen/core/bond_lengths.json
/usr/lib/python3/dist-packages/pymatgen/core/bonds.py
/usr/lib/python3/dist-packages/pymatgen/core/composition.py
/usr/lib/python3/dist-packages/pymatgen/core/func_groups.json
/usr/lib/python3/dist-packages/pymatgen/core/__init__.py
/usr/lib/python3/dist-packages/pymatgen/core/interface.py
/usr/lib/python3/dist-packages/pymatgen/core/ion.py
/usr/lib/python3/dist-packages/pymatgen/core/lattice.py
/usr/lib/python3/dist-packages/pymatgen/core/libxc_docs.json
/usr/lib/python3/dist-packages/pymatgen/core/libxcfunc.py
/usr/lib/python3/dist-packages/pymatgen/core/molecular_orbitals.py
/usr/lib/python3/dist-packages/pymatgen/core/operations.py
/usr/lib/python3/dist-packages/pymatgen/core/periodic_table.json
/usr/lib/python3/dist-packages/pymatgen/core/periodic_table.py
/usr/lib/python3/dist-packages/pymatgen/core/py.typed
/usr/lib/python3/dist-packages/pymatgen/core/quad_data.json
/usr/lib/python3/dist-packages/pymatgen/core/reconstructions_archive.json
/usr/lib/python3/dist-packages/pymatgen/core/sites.py
/usr/lib/python3/dist-packages/pymatgen/core/spectrum.py
/usr/lib/python3/dist-packages/pymatgen/core/structure.py
/usr/lib/python3/dist-packages/pymatgen/core/surface.py
/usr/lib/python3/dist-packages/pymatgen/core/tensors.py
/usr/lib/python3/dist-packages/pymatgen/core/trajectory.py
/usr/lib/python3/dist-packages/pymatgen/core/units.py
/usr/lib/python3/dist-packages/pymatgen/core/xcfunc.py
/usr/lib/python3/dist-packages/pymatgen/electronic_structure/bandstructure.py
/usr/lib/python3/dist-packages/pymatgen/electronic_structure/boltztrap2.py

Field source: Debian 12 (Bookworm) main amd64

Use this package

OpenFactory can boot this operating system in a browser VM, or start a build that includes the native package name from this record.

Try Debian 12 (Bookworm) in the browser Build an image that includes python3-pymatgen

Versions, suites, and repositories

Each row is recorded package-index metadata for one version, architecture, suite, and repository. Names, URLs, and sizes are source-reported; a link is a potentially mutable retrieval location, not an OpenFactory redistribution claim or proof that OpenFactory retained the artifact bytes.

Version	Release	Architecture	Repository	Package size	Installed size	Publisher repository artifact
2022.11.7+dfsg1-11+deb12u2	bookworm / main	amd64	Debian 12 · main · amd64	2.0 MiB	15 MiB	pool/main/p/pymatgen/python3-pymatgen_2022.11.7+dfsg1-11+deb12u2_amd64.deb
2022.11.7+dfsg1-11+deb12u2	bookworm / main	arm64	Debian 12 · main · arm64	1.9 MiB	15 MiB	pool/main/p/pymatgen/python3-pymatgen_2022.11.7+dfsg1-11+deb12u2_arm64.deb

Field source: Debian 12 (Bookworm) main amd64

Known vulnerabilities

Matching against OpenFactory catalog package versions is in progress.

CVE Severity Version impact

CVE	Severity	Version impact
[CVE-2022-42964] Published: Nov 9, 2022, 8:15:00 PM UTC pymatgen: CVE-2022-42964	Medium	Unknown Matching against OpenFactory catalog package versions is in progress. Observed: Oct 23, 2026, 6:30:18 PM UTC Details (2) `2022.11.7+dfsg1-11+deb12u2` · amd64 · bookworm Affected · Fixed: `2022.11.7+dfsg1-11+deb12u2` dsa · pymatgen · debian · bookworm `2022.11.7+dfsg1-11+deb12u2` · arm64 · bookworm Affected · Fixed: `2022.11.7+dfsg1-11+deb12u2` dsa · pymatgen · debian · bookworm

[CVE-2022-42964]

Published: Nov 9, 2022, 8:15:00 PM UTC

pymatgen: CVE-2022-42964

Medium

Unknown

Matching against OpenFactory catalog package versions is in progress. Observed: Oct 23, 2026, 6:30:18 PM UTC

Details (2)

2022.11.7+dfsg1-11+deb12u2 · amd64 · bookworm
Affected · Fixed: 2022.11.7+dfsg1-11+deb12u2
dsa · pymatgen · debian · bookworm
2022.11.7+dfsg1-11+deb12u2 · arm64 · bookworm
Affected · Fixed: 2022.11.7+dfsg1-11+deb12u2
dsa · pymatgen · debian · bookworm

Last synced: Oct 28, 2026, 3:52:27 AM UTC

[CVE catalog]

Checksums

Repository signatures authenticate metadata. Artifact hashing is recorded separately. Neither establishes package safety.

2022.11.7+dfsg1-11+deb12u2 / amd64Observed Sep 1, 2026sha256 4eb2b2523f21…586fe8d1Source-reported digest

Metadata observed; artifact bytes were not independently fetched or hashed by this catalog import. The digest below is source-reported.

Source-reported digest (sha256): 4eb2b2523f21acf6fb5ab39e7ab5bf62e68838139e00cddad3b7ad2e586fe8d1

Verify download

printf '%s  %s\n' '4eb2b2523f21acf6fb5ab39e7ab5bf62e68838139e00cddad3b7ad2e586fe8d1' 'python3-pymatgen_2022.11.7+dfsg1-11+deb12u2_amd64.deb' | sha256sum --check --strict -

Field source: Debian 12 (Bookworm) main amd64

2022.11.7+dfsg1-11+deb12u2 / arm64Observed Sep 1, 2026sha256 655d5ac44730…31add5daSource-reported digest

Metadata observed; artifact bytes were not independently fetched or hashed by this catalog import. The digest below is source-reported.

Source-reported digest (sha256): 655d5ac447301fa973983a96ade5eff63670809ff84487bba9466d0231add5da

Verify download

printf '%s  %s\n' '655d5ac447301fa973983a96ade5eff63670809ff84487bba9466d0231add5da' 'python3-pymatgen_2022.11.7+dfsg1-11+deb12u2_arm64.deb' | sha256sum --check --strict -

Field source: Debian 12 (Bookworm) main arm64

Sources

Debian 12 (Bookworm) main amd64Sep 1, 2026
Authoritative source; repository metadata signature verified
Signature evidence
bookworm-main-amd64:9e0b5aabb2465b3d2e7a7fe27f9913846277833f7a2826e7767acccff5b588c5
Repository-signature verification record
Signed object
https://deb.debian.org/debian/dists/bookworm/InRelease
Signed-object SHA-256
77737fa4b34f2693e982cc9ee35736816c35a7778fc2d326cc1bbf5b301fe1aa
Signer fingerprint
4CB50190207B4758A3F73A796ED0E7B82643E131
Keyring revision
debian-archive-keyring.gpg
SHA-256 506b815cbb32d9b6066b4a2aa524071e071761e7e7f68c3ac74f3061ba852017
Tool and policy
gpgv (GnuPG) 2.4.9
openfactory-software-catalog-signature-v1
Verification time
Sep 1, 2026
Repository metadata hash linkage
Path
main/binary-amd64/Packages.xz
Expected SHA-256
9e0b5aabb2465b3d2e7a7fe27f9913846277833f7a2826e7767acccff5b588c5
Observed SHA-256
9e0b5aabb2465b3d2e7a7fe27f9913846277833f7a2826e7767acccff5b588c5
Result
match verified
Debian 12 (Bookworm) main arm64Sep 1, 2026
Authoritative source; repository metadata signature verified
Signature evidence
bookworm-main-arm64:2ddb1737692e8c45c53e8d57c0ce4cd21c78c5703b830c3226b1423566a06c00
Repository-signature verification record
Signed object
https://deb.debian.org/debian/dists/bookworm/InRelease
Signed-object SHA-256
77737fa4b34f2693e982cc9ee35736816c35a7778fc2d326cc1bbf5b301fe1aa
Signer fingerprint
4CB50190207B4758A3F73A796ED0E7B82643E131
Keyring revision
debian-archive-keyring.gpg
SHA-256 506b815cbb32d9b6066b4a2aa524071e071761e7e7f68c3ac74f3061ba852017
Tool and policy
gpgv (GnuPG) 2.4.9
openfactory-software-catalog-signature-v1
Verification time
Sep 1, 2026
Repository metadata hash linkage
Path
main/binary-arm64/Packages.xz
Expected SHA-256
2ddb1737692e8c45c53e8d57c0ce4cd21c78c5703b830c3226b1423566a06c00
Observed SHA-256
2ddb1737692e8c45c53e8d57c0ce4cd21c78c5703b830c3226b1423566a06c00
Result
match verified
Debian 12 (Bookworm) security main amd64Sep 1, 2026
Authoritative source; repository metadata signature verified
Signature evidence
bookworm-security-main-amd64:f6c2fe702b8cabb044e7bb46c5eaf3962abb6cfed5fcac896ffeb271b9d15104
Repository-signature verification record
Signed object
https://security.debian.org/debian-security/dists/bookworm-security/InRelease
Signed-object SHA-256
6d12b591dde8841119e7e66de94b2af438681faebffabe08ea364290f7aaee1c
Signer fingerprint
ED541312A33F1128F10B1C6C54404762BBB6E853
Keyring revision
debian-archive-keyring.gpg
SHA-256 506b815cbb32d9b6066b4a2aa524071e071761e7e7f68c3ac74f3061ba852017
Tool and policy
gpgv (GnuPG) 2.4.9
openfactory-software-catalog-signature-v1
Verification time
Sep 1, 2026
Repository metadata hash linkage
Path
main/binary-amd64/Packages.xz
Expected SHA-256
f6c2fe702b8cabb044e7bb46c5eaf3962abb6cfed5fcac896ffeb271b9d15104
Observed SHA-256
f6c2fe702b8cabb044e7bb46c5eaf3962abb6cfed5fcac896ffeb271b9d15104
Result
match verified
Debian 12 (Bookworm) security main arm64Sep 1, 2026
Authoritative source; repository metadata signature verified
Signature evidence
bookworm-security-main-arm64:f9b8756324afddf50b1c19d6d46164158c0361909fddc40b48777ad665dfdb14
Repository-signature verification record
Signed object
https://security.debian.org/debian-security/dists/bookworm-security/InRelease
Signed-object SHA-256
6d12b591dde8841119e7e66de94b2af438681faebffabe08ea364290f7aaee1c
Signer fingerprint
ED541312A33F1128F10B1C6C54404762BBB6E853
Keyring revision
debian-archive-keyring.gpg
SHA-256 506b815cbb32d9b6066b4a2aa524071e071761e7e7f68c3ac74f3061ba852017
Tool and policy
gpgv (GnuPG) 2.4.9
openfactory-software-catalog-signature-v1
Verification time
Sep 1, 2026
Repository metadata hash linkage
Path
main/binary-arm64/Packages.xz
Expected SHA-256
f9b8756324afddf50b1c19d6d46164158c0361909fddc40b48777ad665dfdb14
Observed SHA-256
f9b8756324afddf50b1c19d6d46164158c0361909fddc40b48777ad665dfdb14
Result
match verified