python3-pymatgen-core (2026.4.7+dfsg1-5ubuntu1)

Details

Core information at a glance

Distribution
ubuntu
Origin
ubuntu-stonking
Repository
https://ports.ubuntu.com
Codename
stonking
Component
universe
Source
pymatgen-core
Architecture
s390x
Section
universe/python
Priority
optional
Maintainer
Ubuntu Developers <[email protected]>

Size & integrity

Byte sizes and integrity verification

Installed size
12.9 kB
Size expected
2.1 MB
Size actual
2.1 MB
Size match

Dependencies

Required package dependencies

  • python3 (<< 3.15)
  • python3 (>= 3.14~)
  • python3-bibtexparser
  • python3-joblib (>= 1.3.2~)
  • python3-matplotlib (>= 3.8~)
  • python3-monty (>= 2026.2.18~)
  • python3-networkx (>= 3~)
  • python3-numpy
  • python3-numpy2-abi0 | python3-numpy-abi9
  • python3-orjson
  • python3-palettable (>= 3.3.3~)
  • python3-pandas (>= 2~)
  • python3-plotly (>= 5.0.0~)
  • python3-requests (>= 2.32.5~)
  • python3-scipy (>= 1.13.0~)
  • python3-spglib (>= 2.5.0~)
  • python3-sympy (>= 1.6.2~)
  • python3-tabulate (>= 0.9~)
  • python3-tqdm (>= 4.67.3~)
  • python3-uncertainties (>= 3.1.4~)
  • python3:any
  • libc6 (>= 2.4)

Suggested packages

Recommended additional packages

  • python-pymatgen-doc

Description

Python Materials Genomics for materials analysis

Tags

Package classification tags

None

Checksums

Hash values and integrity verification status

TypeActualMatch
MD53b48f301…13aaaa6a
SHA-138f2d668…18cc957e
SHA-256e02ebfde…1f0c25fa
SHA-51224f90072…191ea953

Contents

Files and directories included

.
usr
usr/lib
usr/lib/python3
usr/lib/python3/dist-packages
usr/lib/python3/dist-packages/pymatgen
usr/lib/python3/dist-packages/pymatgen/alchemy
usr/lib/python3/dist-packages/pymatgen/alchemy/__init__.py
usr/lib/python3/dist-packages/pymatgen/alchemy/filters.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
usr/lib/python3/dist-packages/pymatgen/analysis/chempot_diagram.py
usr/lib/python3/dist-packages/pymatgen/analysis/phase_diagram.py
usr/lib/python3/dist-packages/pymatgen/analysis/reaction_calculator.py
usr/lib/python3/dist-packages/pymatgen/command_line
usr/lib/python3/dist-packages/pymatgen/command_line/__init__.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/mcsqs_caller.py
usr/lib/python3/dist-packages/pymatgen/core
usr/lib/python3/dist-packages/pymatgen/core/ElementColorSchemes.yaml
usr/lib/python3/dist-packages/pymatgen/core/__init__.py
usr/lib/python3/dist-packages/pymatgen/core/adsorption.py
usr/lib/python3/dist-packages/pymatgen/core/bond_lengths.json
usr/lib/python3/dist-packages/pymatgen/core/bond_valence.py
usr/lib/python3/dist-packages/pymatgen/core/bonds.py
usr/lib/python3/dist-packages/pymatgen/core/bonds_jmol_ob.yaml
usr/lib/python3/dist-packages/pymatgen/core/bvparam_1991.yaml
usr/lib/python3/dist-packages/pymatgen/core/cn_opt_params.yaml
usr/lib/python3/dist-packages/pymatgen/core/composition.py
usr/lib/python3/dist-packages/pymatgen/core/data
usr/lib/python3/dist-packages/pymatgen/core/data/g_els.json
usr/lib/python3/dist-packages/pymatgen/core/data/nist_gas_gf.json
usr/lib/python3/dist-packages/pymatgen/core/elasticity
usr/lib/python3/dist-packages/pymatgen/core/elasticity/__init__.py
usr/lib/python3/dist-packages/pymatgen/core/elasticity/elastic.py
usr/lib/python3/dist-packages/pymatgen/core/elasticity/strain.py
usr/lib/python3/dist-packages/pymatgen/core/elasticity/stress.py
usr/lib/python3/dist-packages/pymatgen/core/energy_models.py
usr/lib/python3/dist-packages/pymatgen/core/entries.py
usr/lib/python3/dist-packages/pymatgen/core/ewald.py
usr/lib/python3/dist-packages/pymatgen/core/func_groups.json
usr/lib/python3/dist-packages/pymatgen/core/graphs.py
usr/lib/python3/dist-packages/pymatgen/core/icsd_bv.yaml
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/ionic_radii.json
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/local_env.py
usr/lib/python3/dist-packages/pymatgen/core/molecular_orbitals.py
usr/lib/python3/dist-packages/pymatgen/core/molecule_matcher.py
usr/lib/python3/dist-packages/pymatgen/core/molecule_structure_comparator.py
usr/lib/python3/dist-packages/pymatgen/core/op_params.yaml
usr/lib/python3/dist-packages/pymatgen/core/operations.py
usr/lib/python3/dist-packages/pymatgen/core/periodic_table.json.gz
usr/lib/python3/dist-packages/pymatgen/core/periodic_table.py
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/structure_analyzer.py
usr/lib/python3/dist-packages/pymatgen/core/structure_matcher.py
usr/lib/python3/dist-packages/pymatgen/core/structure_prediction
usr/lib/python3/dist-packages/pymatgen/core/structure_prediction/DLS_bond_params.yaml
usr/lib/python3/dist-packages/pymatgen/core/structure_prediction/__init__.py
usr/lib/python3/dist-packages/pymatgen/core/structure_prediction/data
usr/lib/python3/dist-packages/pymatgen/core/structure_prediction/data/lambda.json
usr/lib/python3/dist-packages/pymatgen/core/structure_prediction/data/pair_correlation.json
usr/lib/python3/dist-packages/pymatgen/core/structure_prediction/dopant_predictor.py
usr/lib/python3/dist-packages/pymatgen/core/structure_prediction/substitution_probability.py
usr/lib/python3/dist-packages/pymatgen/core/structure_prediction/substitutor.py
usr/lib/python3/dist-packages/pymatgen/core/structure_prediction/volume_predictor.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/vesta_cutoffs.yaml
usr/lib/python3/dist-packages/pymatgen/core/xcfunc.py
usr/lib/python3/dist-packages/pymatgen/electronic_structure
usr/lib/python3/dist-packages/pymatgen/electronic_structure/__init__.py
usr/lib/python3/dist-packages/pymatgen/electronic_structure/bandstructure.py
usr/lib/python3/dist-packages/pymatgen/electronic_structure/boltztrap.py
usr/lib/python3/dist-packages/pymatgen/electronic_structure/boltztrap2.py
usr/lib/python3/dist-packages/pymatgen/electronic_structure/cohp.py
usr/lib/python3/dist-packages/pymatgen/electronic_structure/core.py
usr/lib/python3/dist-packages/pymatgen/electronic_structure/dos.py
usr/lib/python3/dist-packages/pymatgen/electronic_structure/plotter.py
usr/lib/python3/dist-packages/pymatgen/io
usr/lib/python3/dist-packages/pymatgen/io/abinit
usr/lib/python3/dist-packages/pymatgen/io/abinit/__init__.py
usr/lib/python3/dist-packages/pymatgen/io/abinit/abiobjects.py
usr/lib/python3/dist-packages/pymatgen/io/abinit/abitimer.py
usr/lib/python3/dist-packages/pymatgen/io/abinit/inputs.py
usr/lib/python3/dist-packages/pymatgen/io/abinit/netcdf.py
usr/lib/python3/dist-packages/pymatgen/io/abinit/pseudos.py
usr/lib/python3/dist-packages/pymatgen/io/abinit/variable.py
usr/lib/python3/dist-packages/pymatgen/io/adf.py
usr/lib/python3/dist-packages/pymatgen/io/ase.py
usr/lib/python3/dist-packages/pymatgen/io/atat.py
usr/lib/python3/dist-packages/pymatgen/io/babel.py
usr/lib/python3/dist-packages/pymatgen/io/cif.py
usr/lib/python3/dist-packages/pymatgen/io/common.py
usr/lib/python3/dist-packages/pymatgen/io/core.py
usr/lib/python3/dist-packages/pymatgen/io/cp2k
usr/lib/python3/dist-packages/pymatgen/io/cp2k/__init__.py
usr/lib/python3/dist-packages/pymatgen/io/cp2k/inputs.py
usr/lib/python3/dist-packages/pymatgen/io/cp2k/outputs.py
usr/lib/python3/dist-packages/pymatgen/io/cp2k/sets.py
usr/lib/python3/dist-packages/pymatgen/io/cp2k/utils.py
usr/lib/python3/dist-packages/pymatgen/io/cssr.py
usr/lib/python3/dist-packages/pymatgen/io/exciting
usr/lib/python3/dist-packages/pymatgen/io/exciting/__init__.py
usr/lib/python3/dist-packages/pymatgen/io/exciting/inputs.py
usr/lib/python3/dist-packages/pymatgen/io/feff
usr/lib/python3/dist-packages/pymatgen/io/feff/MPELNESSet.yaml
usr/lib/python3/dist-packages/pymatgen/io/feff/MPEXAFSSet.yaml
usr/lib/python3/dist-packages/pymatgen/io/feff/MPEXELFSSet.yaml
usr/lib/python3/dist-packages/pymatgen/io/feff/MPXANESSet.yaml
usr/lib/python3/dist-packages/pymatgen/io/feff/__init__.py
usr/lib/python3/dist-packages/pymatgen/io/feff/inputs.py
usr/lib/python3/dist-packages/pymatgen/io/feff/outputs.py
usr/lib/python3/dist-packages/pymatgen/io/feff/sets.py
usr/lib/python3/dist-packages/pymatgen/io/fiesta.py
usr/lib/python3/dist-packages/pymatgen/io/gaussian.py
usr/lib/python3/dist-packages/pymatgen/io/icet.py
usr/lib/python3/dist-packages/pymatgen/io/jarvis.py
usr/lib/python3/dist-packages/pymatgen/io/jdftx
usr/lib/python3/dist-packages/pymatgen/io/jdftx/BaseJdftxSet.yaml
usr/lib/python3/dist-packages/pymatgen/io/jdftx/__init__.py
usr/lib/python3/dist-packages/pymatgen/io/jdftx/_output_utils.py
usr/lib/python3/dist-packages/pymatgen/io/jdftx/generic_tags.py
usr/lib/python3/dist-packages/pymatgen/io/jdftx/inputs.py
usr/lib/python3/dist-packages/pymatgen/io/jdftx/jdftxinfile_default_inputs.py
usr/lib/python3/dist-packages/pymatgen/io/jdftx/jdftxinfile_master_format.py
usr/lib/python3/dist-packages/pymatgen/io/jdftx/jdftxinfile_ref_options.py
usr/lib/python3/dist-packages/pymatgen/io/jdftx/jdftxoutfileslice.py
usr/lib/python3/dist-packages/pymatgen/io/jdftx/jelstep.py
usr/lib/python3/dist-packages/pymatgen/io/jdftx/jminsettings.py
usr/lib/python3/dist-packages/pymatgen/io/jdftx/joutstructure.py
usr/lib/python3/dist-packages/pymatgen/io/jdftx/joutstructures.py
usr/lib/python3/dist-packages/pymatgen/io/jdftx/outputs.py
usr/lib/python3/dist-packages/pymatgen/io/jdftx/sets.py
usr/lib/python3/dist-packages/pymatgen/io/lammps
usr/lib/python3/dist-packages/pymatgen/io/lammps/CoeffsDataType.yaml
usr/lib/python3/dist-packages/pymatgen/io/lammps/__init__.py
usr/lib/python3/dist-packages/pymatgen/io/lammps/data.py
usr/lib/python3/dist-packages/pymatgen/io/lammps/generators.py
usr/lib/python3/dist-packages/pymatgen/io/lammps/inputs.py
usr/lib/python3/dist-packages/pymatgen/io/lammps/outputs.py
usr/lib/python3/dist-packages/pymatgen/io/lammps/sets.py
usr/lib/python3/dist-packages/pymatgen/io/lammps/templates
usr/lib/python3/dist-packages/pymatgen/io/lammps/templates/md.template
usr/lib/python3/dist-packages/pymatgen/io/lammps/templates/minimization.template
usr/lib/python3/dist-packages/pymatgen/io/lammps/templates/msd.template
usr/lib/python3/dist-packages/pymatgen/io/lammps/templates/thermalization.template
usr/lib/python3/dist-packages/pymatgen/io/lammps/utils.py
usr/lib/python3/dist-packages/pymatgen/io/lmto.py
usr/lib/python3/dist-packages/pymatgen/io/lobster
usr/lib/python3/dist-packages/pymatgen/io/lobster/__init__.py
usr/lib/python3/dist-packages/pymatgen/io/lobster/future
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/__init__.py
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/constants.py
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/core.py
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/inputs.py
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/lobster_basis
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/lobster_basis/BASIS_PBE_54_max.yaml
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/lobster_basis/BASIS_PBE_54_min.yaml
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/lobster_basis/BASIS_PBE_54_standard.yaml
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/lobsterenv.py
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/outputs
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/outputs/__init__.py
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/outputs/bands.py
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/outputs/coxxcar.py
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/outputs/doscar.py
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/outputs/icoxxlist.py
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/outputs/lobsterout.py
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/outputs/misc.py
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/outputs/populations.py
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/types.py
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/utils.py
usr/lib/python3/dist-packages/pymatgen/io/lobster/future/versioning.py
usr/lib/python3/dist-packages/pymatgen/io/lobster/inputs.py
usr/lib/python3/dist-packages/pymatgen/io/lobster/lobster_basis
usr/lib/python3/dist-packages/pymatgen/io/lobster/lobster_basis/BASIS_PBE_54_max.yaml
usr/lib/python3/dist-packages/pymatgen/io/lobster/lobster_basis/BASIS_PBE_54_min.yaml
usr/lib/python3/dist-packages/pymatgen/io/lobster/lobster_basis/BASIS_PBE_54_standard.yaml
usr/lib/python3/dist-packages/pymatgen/io/lobster/lobsterenv.py
usr/lib/python3/dist-packages/pymatgen/io/lobster/outputs.py
usr/lib/python3/dist-packages/pymatgen/io/lobster/sets.py
usr/lib/python3/dist-packages/pymatgen/io/multiwfn.py
usr/lib/python3/dist-packages/pymatgen/io/nwchem.py
usr/lib/python3/dist-packages/pymatgen/io/openff.py
usr/lib/python3/dist-packages/pymatgen/io/optimade.py
usr/lib/python3/dist-packages/pymatgen/io/packmol.py
usr/lib/python3/dist-packages/pymatgen/io/phonopy.py
usr/lib/python3/dist-packages/pymatgen/io/prismatic.py
usr/lib/python3/dist-packages/pymatgen/io/pwmat
usr/lib/python3/dist-packages/pymatgen/io/pwmat/__init__.py
usr/lib/python3/dist-packages/pymatgen/io/pwmat/inputs.py
usr/lib/python3/dist-packages/pymatgen/io/pwmat/outputs.py
usr/lib/python3/dist-packages/pymatgen/io/pwscf.py
usr/lib/python3/dist-packages/pymatgen/io/qchem
usr/lib/python3/dist-packages/pymatgen/io/qchem/__init__.py
usr/lib/python3/dist-packages/pymatgen/io/qchem/inputs.py
usr/lib/python3/dist-packages/pymatgen/io/qchem/outputs.py
usr/lib/python3/dist-packages/pymatgen/io/qchem/sets.py
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usr/lib/python3/dist-packages/pymatgen/io/res.py
usr/lib/python3/dist-packages/pymatgen/io/shengbte.py
usr/lib/python3/dist-packages/pymatgen/io/template.py
usr/lib/python3/dist-packages/pymatgen/io/vasp
usr/lib/python3/dist-packages/pymatgen/io/vasp/MITRelaxSet.yaml
usr/lib/python3/dist-packages/pymatgen/io/vasp/MP24RelaxSet.yaml
usr/lib/python3/dist-packages/pymatgen/io/vasp/MPAbsorptionSet.yaml
usr/lib/python3/dist-packages/pymatgen/io/vasp/MPHSERelaxSet.yaml
usr/lib/python3/dist-packages/pymatgen/io/vasp/MPRelaxSet.yaml
usr/lib/python3/dist-packages/pymatgen/io/vasp/MPSCANRelaxSet.yaml
usr/lib/python3/dist-packages/pymatgen/io/vasp/MVLGWSet.yaml
usr/lib/python3/dist-packages/pymatgen/io/vasp/MVLRelax52Set.yaml
usr/lib/python3/dist-packages/pymatgen/io/vasp/MatPESStaticSet.yaml
usr/lib/python3/dist-packages/pymatgen/io/vasp/PBE54Base.yaml
usr/lib/python3/dist-packages/pymatgen/io/vasp/PBE64Base.yaml
usr/lib/python3/dist-packages/pymatgen/io/vasp/VASPIncarBase.yaml
usr/lib/python3/dist-packages/pymatgen/io/vasp/__init__.py
usr/lib/python3/dist-packages/pymatgen/io/vasp/help.py
usr/lib/python3/dist-packages/pymatgen/io/vasp/incar_parameters.json
usr/lib/python3/dist-packages/pymatgen/io/vasp/inputs.py
usr/lib/python3/dist-packages/pymatgen/io/vasp/optics.py
usr/lib/python3/dist-packages/pymatgen/io/vasp/outputs.py
usr/lib/python3/dist-packages/pymatgen/io/vasp/potcar-summary-stats.json.bz2
usr/lib/python3/dist-packages/pymatgen/io/vasp/sets.py
usr/lib/python3/dist-packages/pymatgen/io/vasp/vasp_potcar_file_hashes.json
usr/lib/python3/dist-packages/pymatgen/io/vasp/vasp_potcar_pymatgen_hashes.json
usr/lib/python3/dist-packages/pymatgen/io/vasp/vdW_parameters.yaml
usr/lib/python3/dist-packages/pymatgen/io/wannier90.py
usr/lib/python3/dist-packages/pymatgen/io/xcrysden.py
usr/lib/python3/dist-packages/pymatgen/io/xr.py
usr/lib/python3/dist-packages/pymatgen/io/xtb
usr/lib/python3/dist-packages/pymatgen/io/xtb/__init__.py
usr/lib/python3/dist-packages/pymatgen/io/xtb/inputs.py
usr/lib/python3/dist-packages/pymatgen/io/xtb/outputs.py
usr/lib/python3/dist-packages/pymatgen/io/xyz.py
usr/lib/python3/dist-packages/pymatgen/io/zeopp.py
usr/lib/python3/dist-packages/pymatgen/optimization
usr/lib/python3/dist-packages/pymatgen/optimization/__init__.py
usr/lib/python3/dist-packages/pymatgen/optimization/neighbors.cpython-314-s390x-linux-gnu.so
usr/lib/python3/dist-packages/pymatgen/phonon
usr/lib/python3/dist-packages/pymatgen/phonon/__init__.py
usr/lib/python3/dist-packages/pymatgen/phonon/bandstructure.py
usr/lib/python3/dist-packages/pymatgen/phonon/dos.py
usr/lib/python3/dist-packages/pymatgen/phonon/gruneisen.py
usr/lib/python3/dist-packages/pymatgen/phonon/ir_spectra.py
usr/lib/python3/dist-packages/pymatgen/phonon/plotter.py
usr/lib/python3/dist-packages/pymatgen/phonon/thermal_displacements.py
usr/lib/python3/dist-packages/pymatgen/symmetry
usr/lib/python3/dist-packages/pymatgen/symmetry/__init__.py
usr/lib/python3/dist-packages/pymatgen/symmetry/analyzer.py
usr/lib/python3/dist-packages/pymatgen/symmetry/bandstructure.py
usr/lib/python3/dist-packages/pymatgen/symmetry/groups.py
usr/lib/python3/dist-packages/pymatgen/symmetry/kpath.py
usr/lib/python3/dist-packages/pymatgen/symmetry/maggroups.py
usr/lib/python3/dist-packages/pymatgen/symmetry/settings.py
usr/lib/python3/dist-packages/pymatgen/symmetry/site_symmetries.py
usr/lib/python3/dist-packages/pymatgen/symmetry/structure.py
usr/lib/python3/dist-packages/pymatgen/symmetry/symm_data.json
usr/lib/python3/dist-packages/pymatgen/symmetry/symm_data.yaml
usr/lib/python3/dist-packages/pymatgen/symmetry/symm_data_magnetic.sqlite
usr/lib/python3/dist-packages/pymatgen/symmetry/symm_ops.json
usr/lib/python3/dist-packages/pymatgen/symmetry/symm_ops.yaml
usr/lib/python3/dist-packages/pymatgen/transformations
usr/lib/python3/dist-packages/pymatgen/transformations/__init__.py
usr/lib/python3/dist-packages/pymatgen/transformations/advanced_transformations.py
usr/lib/python3/dist-packages/pymatgen/transformations/site_transformations.py
usr/lib/python3/dist-packages/pymatgen/transformations/standard_transformations.py
usr/lib/python3/dist-packages/pymatgen/transformations/transformation_abc.py
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