Pakket: python3-pymatgen (2025.10.7+dfsg1-1 en anderen)

[ Bron: pymatgen  ]

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.

Andere aan python3-pymatgen gerelateerde pakketten

• dep: libc6 (>= 2.14) [amd64]

  GNU C Bibliotheek: Gedeelde bibliotheken
  Ook een virtueel pakket geboden door: libc6-udeb

  dep: libc6 (>= 2.17) [arm64, ppc64el]

  dep: libc6 (>= 2.27) [riscv64]

  dep: libc6 (>= 2.3.4) [hppa]

  dep: libc6 (>= 2.37) [sh4]

  dep: libc6 (>= 2.4) [armhf, i386, m68k, ppc64, s390x, sparc64]

  dep: libc6 (>= 2.41) [loong64]

• dep: libc6.1 (>= 2.4) [alpha]

  GNU C Bibliotheek: Gedeelde bibliotheken
  Ook een virtueel pakket geboden door: libc6.1-udeb

• dep: python3

  interactive high-level object-oriented language (default python3 version)

  dep: python3 (<< 3.13) [alpha, hppa, m68k, sh4]

  dep: python3 (<< 3.14) [niet alpha, amd64, hppa, m68k, sh4]

  dep: python3 (<< 3.15) [amd64]

  dep: python3 (>= 3.11~) [alpha, hppa, m68k, sh4]

  dep: python3 (>= 3.13~) [niet alpha, hppa, m68k, sh4]

• dep: python3-bibtexparser [amd64, riscv64]

  Python 3 library to parse bibtex files

• dep: python3-frozendict [alpha, hppa]

  immutable dictionary

• dep: python3-joblib [m68k, sh4]

  tools to provide lightweight pipelining in Python

  dep: python3-joblib (>= 1~) [niet alpha, hppa, m68k, sh4]

• dep: python3-matplotlib (>= 1.5~) [alpha, hppa, m68k, sh4]

  Python based plotting system in a style similar to Matlab

  dep: python3-matplotlib (>= 3.8~) [niet alpha, hppa, m68k, sh4]

• dep: python3-monty (>= 2025.1.9~) [niet alpha, hppa, m68k, sh4]

  missing complement to Python (Python 3)

  dep: python3-monty (>= 3.0.2~) [alpha, hppa, m68k, sh4]

• dep: python3-mp-api [alpha, hppa]

  Materials Project API for Python

• dep: python3-networkx (>= 2.2~) [alpha, hppa, m68k, sh4]

  tool to create, manipulate and study complex networks (Python3)

  dep: python3-networkx (>= 3~) [niet alpha, hppa, m68k, sh4]

• dep: python3-numpy [niet alpha, hppa, m68k, sh4]

  Python library for numerical computations (Python 3)

  dep: python3-numpy (>= 1.20.1~) [alpha, hppa]

  dep: python3-numpy (>= 1.25.0~) [m68k, sh4]

• dep: python3-numpy2-abi0 [niet alpha, hppa, m68k, sh4]

  virtueel pakket geboden door python3-numpy

  of python3-numpy-abi9

  virtueel pakket geboden door python3-numpy

• dep: python3-orjson [amd64, riscv64]

  JSON parsing Python library

• dep: python3-palettable (>= 3.1.1~) [alpha, hppa, m68k, sh4]

  library of color palettes for Python (Python 3)

  dep: python3-palettable (>= 3.3.3~) [niet alpha, hppa, m68k, sh4]

• dep: python3-pandas (>= 1.1.3~) [alpha, hppa, m68k, sh4]

  data structures for "relational" or "labeled" data

  dep: python3-pandas (>= 2~) [niet alpha, hppa, m68k, sh4]

• dep: python3-plotly (>= 4.5.0~) [alpha, hppa, m68k, sh4]

  Python 3 plotting library for publication-quality graphs

  dep: python3-plotly (>= 5.0.0~) [niet alpha, hppa, m68k, sh4]

• dep: python3-pybtex (>= 0.22.2~) [alpha, hppa, m68k, sh4]

  BibTeX-compatible bibliography processor - Python 3 module

  dep: python3-pybtex (>= 0.24.0~) [niet alpha, amd64, hppa, m68k, riscv64, sh4]

• dep: python3-requests (>= 2.24.0~) [alpha, hppa, m68k, sh4]

  elegant and simple HTTP library for Python3, built for human beings

  dep: python3-requests (>= 2.32~) [niet alpha, hppa, m68k, sh4]

• dep: python3-ruamel.yaml (>= 0.17.0~)

  Roundtrip YAML parser/emitter (Python 3 module)

• dep: python3-scipy (>= 1.13.0~) [niet alpha, hppa, m68k, sh4]

  scientific tools for Python 3

  dep: python3-scipy (>= 1.5.2~) [alpha, hppa, m68k, sh4]

• dep: python3-spglib (>= 2.0.2~) [alpha, hppa, m68k, sh4]

  C library for crystal symmetry determination - Python3 bindings

  dep: python3-spglib (>= 2.5.0~) [niet alpha, hppa, m68k, sh4]

• dep: python3-sympy (>= 1.6.2~)

  Computer Algebra System (CAS) in Python (Python 3)

• dep: python3-tabulate (>= 0.8.7~) [alpha, hppa, m68k, sh4]

  pretty-print tabular data in Python3

  dep: python3-tabulate (>= 0.9~) [niet alpha, hppa, m68k, sh4]

• dep: python3-tqdm (>= 4.41.0~) [alpha, hppa, m68k, sh4]

  fast, extensible progress bar for Python 3 and CLI tool

  dep: python3-tqdm (>= 4.60~) [niet alpha, hppa, m68k, sh4]

• dep: python3-uncertainties (>= 3.1.4~)

  Python3 module for calculations with uncertainties

• rec: python3-ase (>= 3.22.1~) [alpha, hppa, m68k, sh4]

  Atomic Simulation Environment (Python 3)

  rec: python3-ase (>= 3.23.0~) [niet alpha, hppa, m68k, sh4]

• rec: python3-mp-api (>= 0.27.3~) [alpha, hppa, m68k, sh4]

  Materials Project API for Python

• rec: python3-openbabel

  Chemical toolbox library (Python bindings)

• rec: python3-vtk9 [niet alpha, hppa, m68k, sh4]

  Python bindings for VTK

  of python3-paraview

  Parallel Visualization Application. python-support
  Ook een virtueel pakket geboden door: python3-paraview

• sug: python-pymatgen-doc

  Python Materials Genomics for materials analysis (documentation)

• sug: python3-mp-api (>= 0.27.3~) [niet alpha, hppa, m68k, sh4]

  Materials Project API for Python

python3-pymatgen downloaden

Pakket downloaden voor alle beschikbare platforms

Platform	Versie	Pakketgrootte	Geïnstalleerde grootte	Bestanden
alpha (unofficial port)	2023.06.23+dfsg1-4	2.087,5 kB	16.005,0 kB	[overzicht]
amd64	2025.10.7+dfsg1-1+b1	2.614,5 kB	15.765,0 kB	[overzicht]
arm64	2025.2.18+dfsg1-5	2.518,2 kB	18.436,0 kB	[overzicht]
armhf	2025.2.18+dfsg1-5	2.519,1 kB	18.298,0 kB	[overzicht]
hppa (unofficial port)	2023.06.23+dfsg1-4	2.088,7 kB	15.766,0 kB	[overzicht]
i386	2025.2.18+dfsg1-5	2.538,4 kB	18.470,0 kB	[overzicht]
loong64 (unofficial port)	2025.2.18+dfsg1-5	2.534,9 kB	18.563,0 kB	[overzicht]
m68k (unofficial port)	2024.1.27+dfsg1-5	2.418,7 kB	15.995,0 kB	[overzicht]
ppc64 (unofficial port)	2025.2.18+dfsg1-5	2.529,9 kB	18.636,0 kB	[overzicht]
ppc64el	2025.2.18+dfsg1-5	2.532,4 kB	18.628,0 kB	[overzicht]
riscv64	2025.10.7+dfsg1-1	2.554,1 kB	15.123,0 kB	[overzicht]
s390x	2025.2.18+dfsg1-5	2.523,5 kB	18.440,0 kB	[overzicht]
sh4 (unofficial port)	2024.1.27+dfsg1-5	2.493,1 kB	16.105,0 kB	[overzicht]
sparc64 (unofficial port)	2025.2.18+dfsg1-5	2.500,9 kB	20.816,0 kB	[overzicht]