Phono3py

Latest version: v3.10.0

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0.9.10

- Fix bug in `kaccum`. When using with `--pa` option, irreducible q-points were
incorrectly indexed.
- `gaccum` is implemented. `gaccum` is very similar to `kaccum`, but for
$\Gamma_\lambda(\omega_\lambda)$.
- spglib update.

0.9.7

- The definition of MSPP is modified so as to be averaged ph-ph interaction
defined as $P_{\mathbf{q}j}$ in the arXiv manuscript. The key in the kappa
hdf5 file is changed from `mspp` to `ave_pp`. The physical unit of
$P_{\mathbf{q}j}$ is set to $\text{eV}^2$.

0.9.6

- Silicon example is put in `example-phono3py` directory.
- Accumulated lattice thermal conductivity is calculated by `kaccum` script.
- JDOS output format was changed.

0.9.5

- In `kappa-xxx.hdf5` file, `heat_capacity` format was changed from
`(irreducible q-point, temperature, phonon band)` to
`(temperature, irreducible q-point, phonon band)`. For `gamma`, previous
document was wrong in the array shape. It is
`(temperature, irreducible q-point, phonon band)`

0.9.4

- The option of `--cutoff_mfp` is renamed to `--boundary_mfp` and now it's on
the document.
- Detailed contribution of `kappa` at each **q**-point and phonon mode is output
to .hdf5 with the keyword `mode_kappa`.

0.8.11

- A new option of `--cutoff_mfp` for including effective boundary mean free
path.
- The option name `--cutfc3` is changed to `--cutoff_fc3`.
- The option name `--cutpair` is changed to `--cutoff_pair`.
- A new option `--ga` is created.
- Fix spectrum plot of joint dos and imaginary part of self energy

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