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Merge branch 'master' into feature-jdftx-outputs
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mkhorton authored Jan 8, 2025
2 parents 32dd0f9 + e2baa68 commit a3c2105
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6 changes: 3 additions & 3 deletions .pre-commit-config.yaml
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Expand Up @@ -8,7 +8,7 @@ ci:

repos:
- repo: https://github.com/astral-sh/ruff-pre-commit
rev: v0.8.1
rev: v0.8.6
hooks:
- id: ruff
args: [--fix, --unsafe-fixes]
Expand All @@ -22,7 +22,7 @@ repos:
- id: trailing-whitespace

- repo: https://github.com/pre-commit/mirrors-mypy
rev: v1.13.0
rev: v1.14.1
hooks:
- id: mypy

Expand Down Expand Up @@ -65,6 +65,6 @@ repos:
args: [--drop-empty-cells, --keep-output]

- repo: https://github.com/RobertCraigie/pyright-python
rev: v1.1.389
rev: v1.1.391
hooks:
- id: pyright
1 change: 0 additions & 1 deletion docs/pymatgen.md

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2 changes: 1 addition & 1 deletion pyproject.toml
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Expand Up @@ -107,7 +107,7 @@ optional = [
"hiphive>=1.3.1",
"jarvis-tools>=2020.7.14",
"matplotlib>=3.8",
"phonopy>=2.23",
"phonopy>=2.33.3",
"seekpath>=2.0.1",
]
# tblite only support Python 3.12+ through conda-forge
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132 changes: 0 additions & 132 deletions src/pymatgen/command_line/OxideTersoffPotentials

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79 changes: 0 additions & 79 deletions src/pymatgen/command_line/bush.lib

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2 changes: 1 addition & 1 deletion src/pymatgen/command_line/critic2_caller.py
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Expand Up @@ -766,7 +766,7 @@ def get_volume_and_charge(nonequiv_idx):
def _parse_stdout(self, stdout):
warnings.warn(
"Parsing critic2 standard output is deprecated and will not be maintained, "
"please use the native JSON output in future.",
"please use the native JSON output in the future.",
DeprecationWarning,
stacklevel=2,
)
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