Rust, Fortran, and Ruby interfaces¶
The Fortran, and Ruby interfaces are expected to work at a certain level, but not supported as well as the Python interface.
Fortran interface spglib_f08.f90 is found in example directory. This fortran interface is originally contributed by Dimitar Pashov and has been updated by some other people. spglib_f.c is obsolete and is not recommended to use.
Rust interface contributed by Seaton Ullberg. The documentation is found at https://docs.rs/crate/spglib/.
Note that this ruby interface was written in ancient times, so may not work with the recent ruby.
The ruby script
ruby directory reads a VASP
POSCAR formatted file and finds the space-group type. The
option refines a slightly distorted structure within tolerance
spacified with the
-s option. The
-o option gives the symmetry
operations of the input structure.
ruby symPoscar.rb POSCAR -s 0.1 -o -l
Some more options are shown with
ruby symPoscar.rb --help
The way to compile the ruby module is explained in ruby/README.