- Bug fixes and catching up the updates of phonopy.
- Most of hdf5 output files are compressed by `gzip` as default. This
compression can be set off, see {ref}`hdf5_compression_option`.
- (Experimental) `phono3py` command accepts `phono3py.yaml` type file as an
input crystal structure by `-c` option. When `DIM` and any structure file are
not given, `phono3py_disp.yaml` (primary) or `phono3py.yaml` (secondary) is
searched in the current directory. Then `phono3py.yaml` type file is used as
the input. By this, semi-automatic phono3py mode is invocked, which acts as
1. `supercell_matrix` corresponding to `DIM` in the `phono3py.yaml` type file
is used if it exists.
2. `phonon_supercell_matrix` corresponding to `DIM_FC2` in the `phono3py.yaml`
type file is used if it exists.
3. `primitive_matrix` in the `phono3py.yaml` type file is used if it exists.
Otherwise, set `PRIMITIVE_AXES = AUTO` when `PRIMITIVE_AXES` is not given.
4. NAC params are read (`NAC = .TRUE.`) if NAC params are contained (primary)
in the `phono3py.yaml` type file or if `BORN` file exists in the current
directory (secondary).