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spglib-python

Spglib for Python. Spglib is a library for finding and handling crystal symmetries written in C.

homepage: https://pypi.python.org/pypi/spglib

Available installations

spglib-python version Supported CPU targets Supported GPU targets EESSI version Module
2.0.2 generic: aarch64, x86_64
Arm: a64fx, neoverse_n1, neoverse_v1, nvidia/grace
AMD: zen2, zen3, zen4
Intel: haswell, skylake_avx512, sapphirerapids, icelake, cascadelake
 (none) 2023.06 spglib-python/2.0.2-gfbf-2022b
2.1.0 generic: aarch64, x86_64
Arm: a64fx, neoverse_n1, neoverse_v1, nvidia/grace
AMD: zen2, zen3, zen4
Intel: haswell, skylake_avx512, sapphirerapids, icelake, cascadelake
 (none) 2023.06 spglib-python/2.1.0-gfbf-2023a
2.6.0 generic: aarch64, x86_64
Arm: a64fx, neoverse_n1, neoverse_v1, nvidia/grace
AMD: zen2, zen3, zen4
Intel: haswell, skylake_avx512, sapphirerapids, icelake, cascadelake
 (none) 2025.06 spglib-python/2.6.0-gfbf-2025a

Extensions

Overview of extensions included in spglib-python installations

pyproject-metadata

pyproject-metadata version spglib-python modules that include it
0.7.1 spglib-python/2.1.0-gfbf-2023a

pyproject_metadata

pyproject_metadata version spglib-python modules that include it
0.9.1 spglib-python/2.6.0-gfbf-2025a

spglib

spglib version spglib-python modules that include it
2.1.0 spglib-python/2.1.0-gfbf-2023a
2.6.0 spglib-python/2.6.0-gfbf-2025a