spglib

Description

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

User instructions

To load the module

$ module load spglib-1.9.9

Documentation is provided at the project website.

Source

https://github.com/atztogo/spglib

License

BSD

Admin notes

I followed the instructions at https://atztogo.github.io/spglib/install.html using the latest tagged git version:

$ git clone https://github.com/atztogo/spglib.git
$ cd spglib
$ mkdir _build; cd _build
$ cmake ..
$ make
$ make install