Spglib
Installed versions
| Resource |
Version |
| Dardel/cpe24.11 |
2.6.0 |
Spglib is a library for finding and handling crystal symmetries written in C https://spglib.github.io/spglib/index.html
How to use
The Spglib library can be built using different toolchains. You can check available modules using
ml PDC/<version>
ml spider spglib
ml avail spglib
For example, to load the module for the Spglib library built with the cpeGNU 21.11 toolchain
ml PDC/<version>
ml spglib/1.16.0-cpeGNU-21.11
To display information on what paths and environment variables are used when loading a
Spglib module
ml show spglib/1.16.0-cpeGNU-21.11
env | grep -i spglib