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Merge pull request #469 from phonopy/release
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Set version 2.32.0
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atztogo authored Dec 5, 2024
2 parents f0d5cee + 2b3959b commit a6fa5aa
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4 changes: 4 additions & 0 deletions doc/changelog.md
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# Change Log

## Dec-5-2024: Version 2.32.0

- Maintenance release including refactoring of SSCHA interface

## Nov-30-2024: Version 2.31.2

- `INCLUDE_BORN` tag and `--include-born` option were removed. NAC params are
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4 changes: 2 additions & 2 deletions doc/conf.py
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# built documents.
#
# The short X.Y version.
version = "2.31"
version = "2.32"
# The full version, including alpha/beta/rc tags.
release = "2.31.2"
release = "2.32.0"

# The language for content autogenerated by Sphinx. Refer to documentation
# for a list of supported languages.
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4 changes: 2 additions & 2 deletions doc/setting-tags.md
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Expand Up @@ -1107,8 +1107,8 @@ example, random displacements generated by {ref}`random_displacements_tag` can
be used to compute force constants. To use symfc, its python module has to be
installed via conda-forge or pip.

When symfc is used, please cite the manuscript:
A. Seko and A. Togo, arXiv:2403.03588.
When symfc is used, please cite the manuscript: A. Seko and A. Togo, Phys. Rev.
B, **110**, 214302 (2024) [[doi](https://doi.org/10.1103/PhysRevB.110.214302)]

```text
FC_CALCULATOR = SYMFC
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2 changes: 1 addition & 1 deletion phonopy/version.py
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# ANY WAY OUT OF THE USE OF THIS SOFTWARE, EVEN IF ADVISED OF THE
# POSSIBILITY OF SUCH DAMAGE.

__version__ = "2.31.2"
__version__ = "2.32.0"
7 changes: 3 additions & 4 deletions pyproject.toml
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dynamic = ["version"]
readme = { file = "README.md", content-type = "text/markdown" }
description = "This is the phonopy module."
authors = [{ name = "Atsushi Togo", email = "atztogo@gmail.com" }]
authors = [{ name = "Atsushi Togo", email = "atz.togo@gmail.com" }]
requires-python = ">=3.9"
dependencies = [
"numpy>=1.17.0",
"PyYAML>=5.3",
"matplotlib>=2.2.2",
"h5py>=3.0",
"spglib>=2.3",
"scipy",
"symfc",
"symfc>=1.1.6",
]
license = { file = "LICENSE" }

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cp2k = ["cp2k-input-tools"]
seekpath = ["seekpath"]
pypolymlp = ["pypolymlp>=0.4.6"]
tools = ["seekpath", "pypolymlp"]
tools = ["seekpath", "pypolymlp>=0.4.6"]

[project.scripts]
phonopy = "phonopy.scripts.phonopy:run"
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