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Add new symmetry fields to structure model #1422

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@ml-evs ml-evs commented Dec 6, 2022

Closes #1415, pending future changes to the specification on symmetry.

To-do:

@ml-evs ml-evs force-pushed the ml-evs/add_space_group_support branch from 5a8559c to ea2009b Compare December 6, 2022 19:45
@ml-evs ml-evs added schema Concerns the schema models models For issues related to the pydantic models directly OPTIMADE v1.2 This label describes actions that have to be taken to be complient with OPTIMADE 1.2 on-hold For PRs/issues that are on-hold for an unspecified time labels Dec 6, 2022
JPBergsma and others added 25 commits October 13, 2023 17:15
removed duplicate requirement
* Use Python 3.9 as the 'base' CI version for linting

* Update pre-commit hooks

* Run `pyupgrade --py39-plus` to upgrade legacy annotations

* Add `--exit-non-zero-on-fix` for ruff

Co-authored-by: Casper Welzel Andersen <[email protected]>

* Use f-string over format

Co-authored-by: Casper Welzel Andersen <[email protected]>

---------

Co-authored-by: Casper Welzel Andersen <[email protected]>
Use pydantic v1 API wih v2 package

Replace `regex` with `pattern`

Use pydantic v2 API for model dumps

Go use pydantic v2 API again

Bump deps in pyproject and adjust for pydantic_settings

Attempt to migrate some pydantic v2 features

Run bump-pydantic

Update deps in requirements

Post pydantic-bump tweak number 3

Post pydantic-bump tweak number 4

Post pydantic-bump tweak number 5

Reintroduce email-validator dep via pydantic extra

Placating mypy

Use lax annotated type rather than validator

Attempt to simplify some tests for pydantic v2

Bump pydantic version in pre-commit

Bump to pydantic 2.3.0
- Reintroduce `http_client` extra as an alias for `http-client`
Still need to pass in a proper REF_TEMPLATE.
Lot's of changes here - mainly in
optimade.server.schemas:retrieve_queryable_properties().
Using the `model_fields` and FieldInfo instead of the generated JSON
Schema. Mainly due to the changes in the generated schema.

This led to a bit of hacking concerning the type (FieldInfo.annotation).
But otherwise, I think this is a better approach. Also implemented for
EntryCollection.get_attribute_fields().

Otherwise, changes here and there to make tests work as well as doing
some static typing sporadically.
Remove mp-api and emmet-core dependencies

Remove emmet-core from requirements file as well

Update mkdocstrings dependency in requirements file
Use the new Python handler for mkdocstrings - updating the configuration
in all_models.md to include all submodules for optimade.models.
Needed to properly ONLY check if annotation was Union or Optional before
using `get_args()`. Otherwise a type required as a list of strings is
unpacked to `str`, which we do not want.
Use enum `.value` for comparison (check if this should be used elsewhere
in the code for any Enum classes/types).
Disable ignoring warning about pydantic v2 deprecations in order to use
pydantic v2 methods in remaining places.

Consider completely removing the special function used for setting
`nullable=true` in JSON schema for 'SHOULD' OPTIMADE support fields. It
seems `nullable` is no longer a valid field in OpenAPI v3.1.0, but also,
the properties/fields this is added to already support the value being
`null`.
This is no longer part of the OpenAPI spec as of v3.1.

Fixes #1814
Also update some static typing here and there.
- Avoid running mypy on tests folder.

- Remove mypy ignore statements from tests

- Revert to having implicit Optional
- Tidy up changes re: `Datatype`

- Revert to using `typing.Callable` due to old Python 3.9 bug

- Move docstring note about dates back to config of Response model

- Revert class name from `Datatype` back to `DataType`

- Remove defunct comment
* Bump pylint from 2.17.5 to 2.17.7 (#1800)

Bumps [pylint](https://github.com/pylint-dev/pylint) from 2.17.5 to 2.17.7.
- [Release notes](https://github.com/pylint-dev/pylint/releases)
- [Commits](pylint-dev/pylint@v2.17.5...v2.17.7)

---
updated-dependencies:
- dependency-name: pylint
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump fastapi from 0.103.1 to 0.103.2 (#1799)

Bumps [fastapi](https://github.com/tiangolo/fastapi) from 0.103.1 to 0.103.2.
- [Release notes](https://github.com/tiangolo/fastapi/releases)
- [Commits](fastapi/fastapi@0.103.1...0.103.2)

---
updated-dependencies:
- dependency-name: fastapi
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump rich from 13.5.3 to 13.6.0 (#1803)

Bumps [rich](https://github.com/Textualize/rich) from 13.5.3 to 13.6.0.
- [Release notes](https://github.com/Textualize/rich/releases)
- [Changelog](https://github.com/Textualize/rich/blob/master/CHANGELOG.md)
- [Commits](Textualize/rich@v13.5.3...v13.6.0)

---
updated-dependencies:
- dependency-name: rich
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump chuhlomin/render-template from 1.7 to 1.8 (#1805)

Bumps [chuhlomin/render-template](https://github.com/chuhlomin/render-template) from 1.7 to 1.8.
- [Release notes](https://github.com/chuhlomin/render-template/releases)
- [Commits](chuhlomin/render-template@v1.7...v1.8)

---
updated-dependencies:
- dependency-name: chuhlomin/render-template
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pylint from 2.17.7 to 3.0.1 (#1807)

Bumps [pylint](https://github.com/pylint-dev/pylint) from 2.17.7 to 3.0.1.
- [Release notes](https://github.com/pylint-dev/pylint/releases)
- [Commits](pylint-dev/pylint@v2.17.7...v3.0.1)

---
updated-dependencies:
- dependency-name: pylint
  dependency-type: direct:development
  update-type: version-update:semver-major
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump ruff from 0.0.291 to 0.0.292 (#1809)

Bumps [ruff](https://github.com/astral-sh/ruff) from 0.0.291 to 0.0.292.
- [Release notes](https://github.com/astral-sh/ruff/releases)
- [Changelog](https://github.com/astral-sh/ruff/blob/main/BREAKING_CHANGES.md)
- [Commits](astral-sh/ruff@v0.0.291...v0.0.292)

---
updated-dependencies:
- dependency-name: ruff
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump mkdocs-material from 9.4.2 to 9.4.4 (#1806)

Bumps [mkdocs-material](https://github.com/squidfunk/mkdocs-material) from 9.4.2 to 9.4.4.
- [Release notes](https://github.com/squidfunk/mkdocs-material/releases)
- [Changelog](https://github.com/squidfunk/mkdocs-material/blob/master/CHANGELOG)
- [Commits](squidfunk/mkdocs-material@9.4.2...9.4.4)

---
updated-dependencies:
- dependency-name: mkdocs-material
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pre-commit from 3.4.0 to 3.5.0 (#1818)

Bumps [pre-commit](https://github.com/pre-commit/pre-commit) from 3.4.0 to 3.5.0.
- [Release notes](https://github.com/pre-commit/pre-commit/releases)
- [Changelog](https://github.com/pre-commit/pre-commit/blob/main/CHANGELOG.md)
- [Commits](pre-commit/pre-commit@v3.4.0...v3.5.0)

---
updated-dependencies:
- dependency-name: pre-commit
  dependency-type: direct:development
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump mkdocs-material from 9.4.4 to 9.4.6 (#1822)

Bumps [mkdocs-material](https://github.com/squidfunk/mkdocs-material) from 9.4.4 to 9.4.6.
- [Release notes](https://github.com/squidfunk/mkdocs-material/releases)
- [Changelog](https://github.com/squidfunk/mkdocs-material/blob/master/CHANGELOG)
- [Commits](squidfunk/mkdocs-material@9.4.4...9.4.6)

---
updated-dependencies:
- dependency-name: mkdocs-material
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump mypy from 1.5.1 to 1.6.0 (#1821)

Bumps [mypy](https://github.com/python/mypy) from 1.5.1 to 1.6.0.
- [Commits](python/mypy@v1.5.1...v1.6.0)

---
updated-dependencies:
- dependency-name: mypy
  dependency-type: direct:development
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
Co-authored-by: Matthew Evans <[email protected]>

* Bump mypy from 1.6.0 to 1.6.1 (#1824)

Bumps [mypy](https://github.com/python/mypy) from 1.6.0 to 1.6.1.
- [Changelog](https://github.com/python/mypy/blob/master/CHANGELOG.md)
- [Commits](python/mypy@v1.6.0...v1.6.1)

---
updated-dependencies:
- dependency-name: mypy
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump ruff from 0.0.292 to 0.1.1 (#1827)

Bumps [ruff](https://github.com/astral-sh/ruff) from 0.0.292 to 0.1.1.
- [Release notes](https://github.com/astral-sh/ruff/releases)
- [Changelog](https://github.com/astral-sh/ruff/blob/main/CHANGELOG.md)
- [Commits](astral-sh/ruff@v0.0.292...v0.1.1)

---
updated-dependencies:
- dependency-name: ruff
  dependency-type: direct:development
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pylint from 3.0.1 to 3.0.2 (#1826)

Bumps [pylint](https://github.com/pylint-dev/pylint) from 3.0.1 to 3.0.2.
- [Release notes](https://github.com/pylint-dev/pylint/releases)
- [Commits](pylint-dev/pylint@v3.0.1...v3.0.2)

---
updated-dependencies:
- dependency-name: pylint
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump black from 23.9.1 to 23.10.0 (#1829)

Bumps [black](https://github.com/psf/black) from 23.9.1 to 23.10.0.
- [Release notes](https://github.com/psf/black/releases)
- [Changelog](https://github.com/psf/black/blob/main/CHANGES.md)
- [Commits](psf/black@23.9.1...23.10.0)

---
updated-dependencies:
- dependency-name: black
  dependency-type: direct:development
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Update `pre-commit` hooks

* Fix linting

* Remove now defunct comment

---------

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
Co-authored-by: Matthew Evans <[email protected]>
Co-authored-by: Matthew Evans <[email protected]>
Update dependencies:
* Bump ruff from 0.1.1 to 0.1.3 (#1839)
* Bump pytest from 7.4.2 to 7.4.3 (#1840)
* Bump black from 23.10.0 to 23.10.1 (#1841)
* Bump mkdocs-material from 9.4.6 to 9.4.7 (#1842)

Update `pre-commit` hooks.


Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
dependabot bot and others added 29 commits December 27, 2023 23:19
Bumps [providers](https://github.com/Materials-Consortia/providers) from `564a499` to `d8322a4`.
- [Commits](Materials-Consortia/providers@564a499...d8322a4)

---
updated-dependencies:
- dependency-name: providers
  dependency-type: direct:production
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
* Bump actions/setup-python from 4 to 5 (#1892)

Bumps [actions/setup-python](https://github.com/actions/setup-python) from 4 to 5.
- [Release notes](https://github.com/actions/setup-python/releases)
- [Commits](actions/setup-python@v4...v5)

---
updated-dependencies:
- dependency-name: actions/setup-python
  dependency-type: direct:production
  update-type: version-update:semver-major
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump chuhlomin/render-template from 1.8 to 1.9 (#1893)

Bumps [chuhlomin/render-template](https://github.com/chuhlomin/render-template) from 1.8 to 1.9.
- [Release notes](https://github.com/chuhlomin/render-template/releases)
- [Commits](chuhlomin/render-template@v1.8...v1.9)

---
updated-dependencies:
- dependency-name: chuhlomin/render-template
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump isort from 5.12.0 to 5.13.0 (#1895)

Bumps [isort](https://github.com/pycqa/isort) from 5.12.0 to 5.13.0.
- [Release notes](https://github.com/pycqa/isort/releases)
- [Changelog](https://github.com/PyCQA/isort/blob/main/CHANGELOG.md)
- [Commits](PyCQA/isort@5.12.0...5.13.0)

---
updated-dependencies:
- dependency-name: isort
  dependency-type: direct:development
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump aiida-core from 2.4.1 to 2.4.2 (#1894)

Bumps [aiida-core](https://github.com/aiidateam/aiida-core) from 2.4.1 to 2.4.2.
- [Release notes](https://github.com/aiidateam/aiida-core/releases)
- [Changelog](https://github.com/aiidateam/aiida-core/blob/main/CHANGELOG.md)
- [Commits](aiidateam/aiida-core@v2.4.1...v2.4.2)

---
updated-dependencies:
- dependency-name: aiida-core
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pre-commit from 3.5.0 to 3.6.0 (#1896)

Bumps [pre-commit](https://github.com/pre-commit/pre-commit) from 3.5.0 to 3.6.0.
- [Release notes](https://github.com/pre-commit/pre-commit/releases)
- [Changelog](https://github.com/pre-commit/pre-commit/blob/main/CHANGELOG.md)
- [Commits](pre-commit/pre-commit@v3.5.0...v3.6.0)

---
updated-dependencies:
- dependency-name: pre-commit
  dependency-type: direct:development
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pymongo from 4.6.0 to 4.6.1 (#1897)

Bumps [pymongo](https://github.com/mongodb/mongo-python-driver) from 4.6.0 to 4.6.1.
- [Release notes](https://github.com/mongodb/mongo-python-driver/releases)
- [Changelog](https://github.com/mongodb/mongo-python-driver/blob/master/doc/changelog.rst)
- [Commits](mongodb/mongo-python-driver@4.6.0...4.6.1)

---
updated-dependencies:
- dependency-name: pymongo
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump ruff from 0.1.6 to 0.1.7 (#1898)

Bumps [ruff](https://github.com/astral-sh/ruff) from 0.1.6 to 0.1.7.
- [Release notes](https://github.com/astral-sh/ruff/releases)
- [Changelog](https://github.com/astral-sh/ruff/blob/main/CHANGELOG.md)
- [Commits](astral-sh/ruff@v0.1.6...v0.1.7)

---
updated-dependencies:
- dependency-name: ruff
  dependency-type: direct:development
  update-type: version-update:semver-patch
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Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump mkdocs-material from 9.4.14 to 9.5.1 (#1899)

Bumps [mkdocs-material](https://github.com/squidfunk/mkdocs-material) from 9.4.14 to 9.5.1.
- [Release notes](https://github.com/squidfunk/mkdocs-material/releases)
- [Changelog](https://github.com/squidfunk/mkdocs-material/blob/master/CHANGELOG)
- [Commits](squidfunk/mkdocs-material@9.4.14...9.5.1)

---
updated-dependencies:
- dependency-name: mkdocs-material
  dependency-type: direct:production
  update-type: version-update:semver-minor
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Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump ruff from 0.1.7 to 0.1.8 (#1902)

Bumps [ruff](https://github.com/astral-sh/ruff) from 0.1.7 to 0.1.8.
- [Release notes](https://github.com/astral-sh/ruff/releases)
- [Changelog](https://github.com/astral-sh/ruff/blob/main/CHANGELOG.md)
- [Commits](astral-sh/ruff@v0.1.7...v0.1.8)

---
updated-dependencies:
- dependency-name: ruff
  dependency-type: direct:development
  update-type: version-update:semver-patch
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Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump mkdocs-material from 9.5.1 to 9.5.2 (#1903)

Bumps [mkdocs-material](https://github.com/squidfunk/mkdocs-material) from 9.5.1 to 9.5.2.
- [Release notes](https://github.com/squidfunk/mkdocs-material/releases)
- [Changelog](https://github.com/squidfunk/mkdocs-material/blob/master/CHANGELOG)
- [Commits](squidfunk/mkdocs-material@9.5.1...9.5.2)

---
updated-dependencies:
- dependency-name: mkdocs-material
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump black from 23.11.0 to 23.12.0 (#1904)

Bumps [black](https://github.com/psf/black) from 23.11.0 to 23.12.0.
- [Release notes](https://github.com/psf/black/releases)
- [Changelog](https://github.com/psf/black/blob/main/CHANGES.md)
- [Commits](psf/black@23.11.0...23.12.0)

---
updated-dependencies:
- dependency-name: black
  dependency-type: direct:development
  update-type: version-update:semver-minor
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Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump isort from 5.13.0 to 5.13.2 (#1905)

Bumps [isort](https://github.com/pycqa/isort) from 5.13.0 to 5.13.2.
- [Release notes](https://github.com/pycqa/isort/releases)
- [Changelog](https://github.com/PyCQA/isort/blob/main/CHANGELOG.md)
- [Commits](PyCQA/isort@5.13.0...5.13.2)

---
updated-dependencies:
- dependency-name: isort
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump fastapi from 0.104.1 to 0.105.0 (#1906)

Bumps [fastapi](https://github.com/tiangolo/fastapi) from 0.104.1 to 0.105.0.
- [Release notes](https://github.com/tiangolo/fastapi/releases)
- [Commits](fastapi/fastapi@0.104.1...0.105.0)

---
updated-dependencies:
- dependency-name: fastapi
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

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Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump uvicorn from 0.24.0.post1 to 0.25.0 (#1910)

Bumps [uvicorn](https://github.com/encode/uvicorn) from 0.24.0.post1 to 0.25.0.
- [Release notes](https://github.com/encode/uvicorn/releases)
- [Changelog](https://github.com/encode/uvicorn/blob/master/CHANGELOG.md)
- [Commits](encode/uvicorn@0.24.0.post1...0.25.0)

---
updated-dependencies:
- dependency-name: uvicorn
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

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* Bump pymatgen from 2023.11.12 to 2023.12.18 (#1911)

Bumps [pymatgen](https://github.com/materialsproject/pymatgen) from 2023.11.12 to 2023.12.18.
- [Release notes](https://github.com/materialsproject/pymatgen/releases)
- [Changelog](https://github.com/materialsproject/pymatgen/blob/master/docs/CHANGES.md)
- [Commits](materialsproject/pymatgen@v2023.11.12...v2023.12.18)

---
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* Bump black from 23.12.0 to 23.12.1 (#1912)

Bumps [black](https://github.com/psf/black) from 23.12.0 to 23.12.1.
- [Release notes](https://github.com/psf/black/releases)
- [Changelog](https://github.com/psf/black/blob/main/CHANGES.md)
- [Commits](psf/black@23.12.0...23.12.1)

---
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- dependency-name: black
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  update-type: version-update:semver-patch
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* Bump aiida-core from 2.4.2 to 2.5.0 (#1913)

Bumps [aiida-core](https://github.com/aiidateam/aiida-core) from 2.4.2 to 2.5.0.
- [Release notes](https://github.com/aiidateam/aiida-core/releases)
- [Changelog](https://github.com/aiidateam/aiida-core/blob/main/CHANGELOG.md)
- [Commits](aiidateam/aiida-core@v2.4.2...v2.5.0)

---
updated-dependencies:
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  update-type: version-update:semver-minor
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* Bump mypy from 1.7.1 to 1.8.0 (#1914)

Bumps [mypy](https://github.com/python/mypy) from 1.7.1 to 1.8.0.
- [Changelog](https://github.com/python/mypy/blob/master/CHANGELOG.md)
- [Commits](python/mypy@v1.7.1...v1.8.0)

---
updated-dependencies:
- dependency-name: mypy
  dependency-type: direct:development
  update-type: version-update:semver-minor
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* Bump httpx from 0.25.2 to 0.26.0 (#1915)

Bumps [httpx](https://github.com/encode/httpx) from 0.25.2 to 0.26.0.
- [Release notes](https://github.com/encode/httpx/releases)
- [Changelog](https://github.com/encode/httpx/blob/master/CHANGELOG.md)
- [Commits](encode/httpx@0.25.2...0.26.0)

---
updated-dependencies:
- dependency-name: httpx
  dependency-type: direct:production
  update-type: version-update:semver-minor
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* Bump ruff from 0.1.8 to 0.1.9 (#1916)

Bumps [ruff](https://github.com/astral-sh/ruff) from 0.1.8 to 0.1.9.
- [Release notes](https://github.com/astral-sh/ruff/releases)
- [Changelog](https://github.com/astral-sh/ruff/blob/main/CHANGELOG.md)
- [Commits](astral-sh/ruff@v0.1.8...v0.1.9)

---
updated-dependencies:
- dependency-name: ruff
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

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* Bump mkdocs-material from 9.5.2 to 9.5.3 (#1917)

Bumps [mkdocs-material](https://github.com/squidfunk/mkdocs-material) from 9.5.2 to 9.5.3.
- [Release notes](https://github.com/squidfunk/mkdocs-material/releases)
- [Changelog](https://github.com/squidfunk/mkdocs-material/blob/master/CHANGELOG)
- [Commits](squidfunk/mkdocs-material@9.5.2...9.5.3)

---
updated-dependencies:
- dependency-name: mkdocs-material
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  update-type: version-update:semver-patch
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* Bump fastapi from 0.105.0 to 0.108.0 (#1918)

Bumps [fastapi](https://github.com/tiangolo/fastapi) from 0.105.0 to 0.108.0.
- [Release notes](https://github.com/tiangolo/fastapi/releases)
- [Commits](fastapi/fastapi@0.105.0...0.108.0)

---
updated-dependencies:
- dependency-name: fastapi
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  update-type: version-update:semver-minor
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* Bump pytest from 7.4.3 to 7.4.4 (#1919)

Bumps [pytest](https://github.com/pytest-dev/pytest) from 7.4.3 to 7.4.4.
- [Release notes](https://github.com/pytest-dev/pytest/releases)
- [Changelog](https://github.com/pytest-dev/pytest/blob/main/CHANGELOG.rst)
- [Commits](pytest-dev/pytest@7.4.3...7.4.4)

---
updated-dependencies:
- dependency-name: pytest
  dependency-type: direct:development
  update-type: version-update:semver-patch
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* Bump jarvis-tools from 2023.9.20 to 2023.12.12 (#1920)

Bumps [jarvis-tools](https://github.com/usnistgov/jarvis) from 2023.9.20 to 2023.12.12.
- [Release notes](https://github.com/usnistgov/jarvis/releases)
- [Commits](https://github.com/usnistgov/jarvis/commits)

---
updated-dependencies:
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  update-type: version-update:semver-minor
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* Update `pre-commit` hooks

* Bump pydantic[email] from 2.3.0 to 2.5.3 (#1922)

Bumps [pydantic[email]](https://github.com/pydantic/pydantic) from 2.3.0 to 2.5.3.
- [Release notes](https://github.com/pydantic/pydantic/releases)
- [Changelog](https://github.com/pydantic/pydantic/blob/v2.5.3/HISTORY.md)
- [Commits](pydantic/pydantic@v2.3.0...v2.5.3)

---
updated-dependencies:
- dependency-name: pydantic[email]
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  update-type: version-update:semver-minor
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---------

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…h over pagination (#1925)

* Add ability to count the results for databases that do not serve `meta->data_returned` via binary search

* Add verbosity flag to client

* Add way to force binary search for testing

* Refactor and properly test binary search
Bumps [providers](https://github.com/Materials-Consortia/providers) from `d8322a4` to `93d2b52`.
- [Commits](Materials-Consortia/providers@d8322a4...93d2b52)

---
updated-dependencies:
- dependency-name: providers
  dependency-type: direct:production
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* Attempt to allow publishing release from backport branches in CI (#1931)

* Backport release CI fix-up attempt no. 2 (#1932)

* Fix typo in CI fix

* Fix GH API call in CI

* Tweak docs build; only tag docs versions as stable if they are released from default branch
Bumps [providers](https://github.com/Materials-Consortia/providers) from `93d2b52` to `97c69be`.
- [Commits](Materials-Consortia/providers@93d2b52...97c69be)

---
updated-dependencies:
- dependency-name: providers
  dependency-type: direct:production
...

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Bumps [providers](https://github.com/Materials-Consortia/providers) from `97c69be` to `46c8d85`.
- [Commits](Materials-Consortia/providers@97c69be...46c8d85)

---
updated-dependencies:
- dependency-name: providers
  dependency-type: direct:production
...

Signed-off-by: dependabot[bot] <[email protected]>
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Bumps [providers](https://github.com/Materials-Consortia/providers) from `46c8d85` to `ad0e214`.
- [Commits](Materials-Consortia/providers@46c8d85...ad0e214)

---
updated-dependencies:
- dependency-name: providers
  dependency-type: direct:production
...

Signed-off-by: dependabot[bot] <[email protected]>
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* Bump ruff from 0.1.9 to 0.1.11 (#1923)

Bumps [ruff](https://github.com/astral-sh/ruff) from 0.1.9 to 0.1.11.
- [Release notes](https://github.com/astral-sh/ruff/releases)
- [Changelog](https://github.com/astral-sh/ruff/blob/main/CHANGELOG.md)
- [Commits](astral-sh/ruff@v0.1.9...v0.1.11)

---
updated-dependencies:
- dependency-name: ruff
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

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* Bump lark from 1.1.7 to 1.1.9 (#1927)

Bumps [lark](https://github.com/lark-parser/lark) from 1.1.7 to 1.1.9.
- [Release notes](https://github.com/lark-parser/lark/releases)
- [Changelog](https://github.com/lark-parser/lark/blob/master/CHANGELOG.md)
- [Commits](lark-parser/lark@1.1.7...1.1.9)

---
updated-dependencies:
- dependency-name: lark
  dependency-type: direct:production
  update-type: version-update:semver-patch
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* Bump ruff from 0.1.11 to 0.1.13 (#1937)

Bumps [ruff](https://github.com/astral-sh/ruff) from 0.1.11 to 0.1.13.
- [Release notes](https://github.com/astral-sh/ruff/releases)
- [Changelog](https://github.com/astral-sh/ruff/blob/main/CHANGELOG.md)
- [Commits](astral-sh/ruff@v0.1.11...v0.1.13)

---
updated-dependencies:
- dependency-name: ruff
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

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* Bump fastapi from 0.108.0 to 0.109.0 (#1938)

Bumps [fastapi](https://github.com/tiangolo/fastapi) from 0.108.0 to 0.109.0.
- [Release notes](https://github.com/tiangolo/fastapi/releases)
- [Commits](fastapi/fastapi@0.108.0...0.109.0)

---
updated-dependencies:
- dependency-name: fastapi
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

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* Bump mkdocs-material from 9.5.3 to 9.5.4 (#1942)

Bumps [mkdocs-material](https://github.com/squidfunk/mkdocs-material) from 9.5.3 to 9.5.4.
- [Release notes](https://github.com/squidfunk/mkdocs-material/releases)
- [Changelog](https://github.com/squidfunk/mkdocs-material/blob/master/CHANGELOG)
- [Commits](squidfunk/mkdocs-material@9.5.3...9.5.4)

---
updated-dependencies:
- dependency-name: mkdocs-material
  dependency-type: direct:production
  update-type: version-update:semver-patch
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* Bump ruff from 0.1.13 to 0.1.14 (#1943)

Bumps [ruff](https://github.com/astral-sh/ruff) from 0.1.13 to 0.1.14.
- [Release notes](https://github.com/astral-sh/ruff/releases)
- [Changelog](https://github.com/astral-sh/ruff/blob/main/CHANGELOG.md)
- [Commits](astral-sh/ruff@v0.1.13...v0.1.14)

---
updated-dependencies:
- dependency-name: ruff
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

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* Bump uvicorn from 0.25.0 to 0.26.0 (#1944)

Bumps [uvicorn](https://github.com/encode/uvicorn) from 0.25.0 to 0.26.0.
- [Release notes](https://github.com/encode/uvicorn/releases)
- [Changelog](https://github.com/encode/uvicorn/blob/master/CHANGELOG.md)
- [Commits](encode/uvicorn@0.25.0...0.26.0)

---
updated-dependencies:
- dependency-name: uvicorn
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

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* Bump pytest from 7.4.4 to 8.0.0 (#1949)

Bumps [pytest](https://github.com/pytest-dev/pytest) from 7.4.4 to 8.0.0.
- [Release notes](https://github.com/pytest-dev/pytest/releases)
- [Changelog](https://github.com/pytest-dev/pytest/blob/main/CHANGELOG.rst)
- [Commits](pytest-dev/pytest@7.4.4...8.0.0)

---
updated-dependencies:
- dependency-name: pytest
  dependency-type: direct:development
  update-type: version-update:semver-major
...

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* Bump uvicorn from 0.26.0 to 0.27.0 (#1950)

Bumps [uvicorn](https://github.com/encode/uvicorn) from 0.26.0 to 0.27.0.
- [Release notes](https://github.com/encode/uvicorn/releases)
- [Changelog](https://github.com/encode/uvicorn/blob/master/CHANGELOG.md)
- [Commits](encode/uvicorn@0.26.0...0.27.0)

---
updated-dependencies:
- dependency-name: uvicorn
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

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Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pymatgen from 2023.12.18 to 2024.1.27 (#1951)

Bumps [pymatgen](https://github.com/materialsproject/pymatgen) from 2023.12.18 to 2024.1.27.
- [Release notes](https://github.com/materialsproject/pymatgen/releases)
- [Changelog](https://github.com/materialsproject/pymatgen/blob/master/docs/CHANGES.md)
- [Commits](materialsproject/pymatgen@v2023.12.18...v2024.1.27)

---
updated-dependencies:
- dependency-name: pymatgen
  dependency-type: direct:production
  update-type: version-update:semver-major
...

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* Bump mkdocs-material from 9.5.4 to 9.5.6 (#1952)

Bumps [mkdocs-material](https://github.com/squidfunk/mkdocs-material) from 9.5.4 to 9.5.6.
- [Release notes](https://github.com/squidfunk/mkdocs-material/releases)
- [Changelog](https://github.com/squidfunk/mkdocs-material/blob/master/CHANGELOG)
- [Commits](squidfunk/mkdocs-material@9.5.4...9.5.6)

---
updated-dependencies:
- dependency-name: mkdocs-material
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

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* Update `pre-commit` hooks

---------

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Update GH Actions:
* Bump peter-evans/create-pull-request from 5 to 6 (#1960)
* Bump codecov/codecov-action from 3 to 4 (#1961)

Add codecov token.


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Bumps [fastapi](https://github.com/tiangolo/fastapi) from 0.109.0 to 0.109.1.
- [Release notes](https://github.com/tiangolo/fastapi/releases)
- [Commits](fastapi/fastapi@0.109.0...0.109.1)

---
updated-dependencies:
- dependency-name: fastapi
  dependency-type: direct:production
...

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* Bump mkdocs-material from 9.5.6 to 9.5.7 (#1963)

Bumps [mkdocs-material](https://github.com/squidfunk/mkdocs-material) from 9.5.6 to 9.5.7.
- [Release notes](https://github.com/squidfunk/mkdocs-material/releases)
- [Changelog](https://github.com/squidfunk/mkdocs-material/blob/master/CHANGELOG)
- [Commits](squidfunk/mkdocs-material@9.5.6...9.5.7)

---
updated-dependencies:
- dependency-name: mkdocs-material
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

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* Bump ruff from 0.1.14 to 0.2.0 (#1964)

Bumps [ruff](https://github.com/astral-sh/ruff) from 0.1.14 to 0.2.0.
- [Release notes](https://github.com/astral-sh/ruff/releases)
- [Changelog](https://github.com/astral-sh/ruff/blob/main/CHANGELOG.md)
- [Commits](astral-sh/ruff@v0.1.14...v0.2.0)

---
updated-dependencies:
- dependency-name: ruff
  dependency-type: direct:development
  update-type: version-update:semver-minor
...

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* Bump pydantic[email] from 2.5.3 to 2.6.0 (#1965)

Bumps [pydantic[email]](https://github.com/pydantic/pydantic) from 2.5.3 to 2.6.0.
- [Release notes](https://github.com/pydantic/pydantic/releases)
- [Changelog](https://github.com/pydantic/pydantic/blob/main/HISTORY.md)
- [Commits](pydantic/pydantic@v2.5.3...v2.6.0)

---
updated-dependencies:
- dependency-name: pydantic[email]
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

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Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump fastapi from 0.109.0 to 0.109.2 (#1966)

Bumps [fastapi](https://github.com/tiangolo/fastapi) from 0.109.0 to 0.109.2.
- [Release notes](https://github.com/tiangolo/fastapi/releases)
- [Commits](fastapi/fastapi@0.109.0...0.109.2)

---
updated-dependencies:
- dependency-name: fastapi
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

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* Bump uvicorn from 0.27.0 to 0.27.0.post1 (#1967)

Bumps [uvicorn](https://github.com/encode/uvicorn) from 0.27.0 to 0.27.0.post1.
- [Release notes](https://github.com/encode/uvicorn/releases)
- [Changelog](https://github.com/encode/uvicorn/blob/master/CHANGELOG.md)
- [Commits](encode/uvicorn@0.27.0...0.27.0.post1)

---
updated-dependencies:
- dependency-name: uvicorn
  dependency-type: direct:production
  update-type: version-update:semver-patch
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* Bump aiida-core from 2.5.0 to 2.5.1 (#1968)

Bumps [aiida-core](https://github.com/aiidateam/aiida-core) from 2.5.0 to 2.5.1.
- [Release notes](https://github.com/aiidateam/aiida-core/releases)
- [Changelog](https://github.com/aiidateam/aiida-core/blob/main/CHANGELOG.md)
- [Commits](aiidateam/aiida-core@v2.5.0...v2.5.1)

---
updated-dependencies:
- dependency-name: aiida-core
  dependency-type: direct:production
  update-type: version-update:semver-patch
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* Bump pre-commit from 3.6.0 to 3.6.1 (#1970)

Bumps [pre-commit](https://github.com/pre-commit/pre-commit) from 3.6.0 to 3.6.1.
- [Release notes](https://github.com/pre-commit/pre-commit/releases)
- [Changelog](https://github.com/pre-commit/pre-commit/blob/main/CHANGELOG.md)
- [Commits](pre-commit/pre-commit@v3.6.0...v3.6.1)

---
updated-dependencies:
- dependency-name: pre-commit
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump mkdocs-material from 9.5.7 to 9.5.9 (#1971)

Bumps [mkdocs-material](https://github.com/squidfunk/mkdocs-material) from 9.5.7 to 9.5.9.
- [Release notes](https://github.com/squidfunk/mkdocs-material/releases)
- [Changelog](https://github.com/squidfunk/mkdocs-material/blob/master/CHANGELOG)
- [Commits](squidfunk/mkdocs-material@9.5.7...9.5.9)

---
updated-dependencies:
- dependency-name: mkdocs-material
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

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Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump ruff from 0.2.0 to 0.2.1 (#1972)

Bumps [ruff](https://github.com/astral-sh/ruff) from 0.2.0 to 0.2.1.
- [Release notes](https://github.com/astral-sh/ruff/releases)
- [Changelog](https://github.com/astral-sh/ruff/blob/main/CHANGELOG.md)
- [Commits](astral-sh/ruff@v0.2.0...v0.2.1)

---
updated-dependencies:
- dependency-name: ruff
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pydantic[email] from 2.6.0 to 2.6.1 (#1973)

Bumps [pydantic[email]](https://github.com/pydantic/pydantic) from 2.6.0 to 2.6.1.
- [Release notes](https://github.com/pydantic/pydantic/releases)
- [Changelog](https://github.com/pydantic/pydantic/blob/main/HISTORY.md)
- [Commits](pydantic/pydantic@v2.6.0...v2.6.1)

---
updated-dependencies:
- dependency-name: pydantic[email]
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pymatgen from 2024.1.27 to 2024.2.8 (#1974)

Bumps [pymatgen](https://github.com/materialsproject/pymatgen) from 2024.1.27 to 2024.2.8.
- [Release notes](https://github.com/materialsproject/pymatgen/releases)
- [Changelog](https://github.com/materialsproject/pymatgen/blob/master/docs/CHANGES.md)
- [Commits](materialsproject/pymatgen@v2024.1.27...v2024.2.8)

---
updated-dependencies:
- dependency-name: pymatgen
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump uvicorn from 0.27.0.post1 to 0.27.1 (#1975)

Bumps [uvicorn](https://github.com/encode/uvicorn) from 0.27.0.post1 to 0.27.1.
- [Release notes](https://github.com/encode/uvicorn/releases)
- [Changelog](https://github.com/encode/uvicorn/blob/master/CHANGELOG.md)
- [Commits](encode/uvicorn@0.27.0.post1...0.27.1)

---
updated-dependencies:
- dependency-name: uvicorn
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pydantic-settings from 2.1.0 to 2.2.0 (#1977)

Bumps [pydantic-settings](https://github.com/pydantic/pydantic-settings) from 2.1.0 to 2.2.0.
- [Release notes](https://github.com/pydantic/pydantic-settings/releases)
- [Commits](pydantic/pydantic-settings@v2.1.0...v2.2.0)

---
updated-dependencies:
- dependency-name: pydantic-settings
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump ruff from 0.2.1 to 0.2.2 (#1978)

Bumps [ruff](https://github.com/astral-sh/ruff) from 0.2.1 to 0.2.2.
- [Release notes](https://github.com/astral-sh/ruff/releases)
- [Changelog](https://github.com/astral-sh/ruff/blob/main/CHANGELOG.md)
- [Commits](astral-sh/ruff@v0.2.1...v0.2.2)

---
updated-dependencies:
- dependency-name: ruff
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pytest from 8.0.0 to 8.0.1 (#1979)

Bumps [pytest](https://github.com/pytest-dev/pytest) from 8.0.0 to 8.0.1.
- [Release notes](https://github.com/pytest-dev/pytest/releases)
- [Changelog](https://github.com/pytest-dev/pytest/blob/main/CHANGELOG.rst)
- [Commits](pytest-dev/pytest@8.0.0...8.0.1)

---
updated-dependencies:
- dependency-name: pytest
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pre-commit from 3.6.1 to 3.6.2 (#1976)

Bumps [pre-commit](https://github.com/pre-commit/pre-commit) from 3.6.1 to 3.6.2.
- [Release notes](https://github.com/pre-commit/pre-commit/releases)
- [Changelog](https://github.com/pre-commit/pre-commit/blob/main/CHANGELOG.md)
- [Commits](pre-commit/pre-commit@v3.6.1...v3.6.2)

---
updated-dependencies:
- dependency-name: pre-commit
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
Co-authored-by: Matthew Evans <[email protected]>

* Update `pre-commit` hooks

---------

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
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* Bump fastapi from 0.109.2 to 0.110.0 (#1983)

Bumps [fastapi](https://github.com/tiangolo/fastapi) from 0.109.2 to 0.110.0.
- [Release notes](https://github.com/tiangolo/fastapi/releases)
- [Commits](fastapi/fastapi@0.109.2...0.110.0)

---
updated-dependencies:
- dependency-name: fastapi
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pymongo from 4.6.1 to 4.6.2 (#1982)

Bumps [pymongo](https://github.com/mongodb/mongo-python-driver) from 4.6.1 to 4.6.2.
- [Release notes](https://github.com/mongodb/mongo-python-driver/releases)
- [Changelog](https://github.com/mongodb/mongo-python-driver/blob/master/doc/changelog.rst)
- [Commits](mongodb/mongo-python-driver@4.6.1...4.6.2)

---
updated-dependencies:
- dependency-name: pymongo
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pymatgen from 2024.2.8 to 2024.2.23 (#1984)

Bumps [pymatgen](https://github.com/materialsproject/pymatgen) from 2024.2.8 to 2024.2.23.
- [Release notes](https://github.com/materialsproject/pymatgen/releases)
- [Changelog](https://github.com/materialsproject/pymatgen/blob/master/docs/CHANGES.md)
- [Commits](materialsproject/pymatgen@v2024.2.8...v2024.2.23)

---
updated-dependencies:
- dependency-name: pymatgen
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pydantic-settings from 2.2.0 to 2.2.1 (#1985)

Bumps [pydantic-settings](https://github.com/pydantic/pydantic-settings) from 2.2.0 to 2.2.1.
- [Release notes](https://github.com/pydantic/pydantic-settings/releases)
- [Commits](pydantic/pydantic-settings@v2.2.0...v2.2.1)

---
updated-dependencies:
- dependency-name: pydantic-settings
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pytest from 8.0.1 to 8.0.2 (#1987)

Bumps [pytest](https://github.com/pytest-dev/pytest) from 8.0.1 to 8.0.2.
- [Release notes](https://github.com/pytest-dev/pytest/releases)
- [Changelog](https://github.com/pytest-dev/pytest/blob/main/CHANGELOG.rst)
- [Commits](pytest-dev/pytest@8.0.1...8.0.2)

---
updated-dependencies:
- dependency-name: pytest
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump mkdocs-material from 9.5.9 to 9.5.11 (#1989)

Bumps [mkdocs-material](https://github.com/squidfunk/mkdocs-material) from 9.5.9 to 9.5.11.
- [Release notes](https://github.com/squidfunk/mkdocs-material/releases)
- [Changelog](https://github.com/squidfunk/mkdocs-material/blob/master/CHANGELOG)
- [Commits](squidfunk/mkdocs-material@9.5.9...9.5.11)

---
updated-dependencies:
- dependency-name: mkdocs-material
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pydantic[email] from 2.6.1 to 2.6.2 (#1986)

Bumps [pydantic[email]](https://github.com/pydantic/pydantic) from 2.6.1 to 2.6.2.
- [Release notes](https://github.com/pydantic/pydantic/releases)
- [Changelog](https://github.com/pydantic/pydantic/blob/main/HISTORY.md)
- [Commits](pydantic/pydantic@v2.6.1...v2.6.2)

---
updated-dependencies:
- dependency-name: pydantic[email]
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
Co-authored-by: Matthew Evans <[email protected]>

* Bump httpx from 0.26.0 to 0.27.0 (#1988)

* Bump httpx from 0.26.0 to 0.27.0

Bumps [httpx](https://github.com/encode/httpx) from 0.26.0 to 0.27.0.
- [Release notes](https://github.com/encode/httpx/releases)
- [Changelog](https://github.com/encode/httpx/blob/master/CHANGELOG.md)
- [Commits](encode/httpx@0.26.0...0.27.0)

---
updated-dependencies:
- dependency-name: httpx
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>

* Add deprecation warning ignore for testclient

---------

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
Co-authored-by: Matthew Evans <[email protected]>

* Update `pre-commit` hooks

* Ruff pre-commit update and bump settings

---------

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
Co-authored-by: Matthew Evans <[email protected]>
Co-authored-by: Matthew Evans <[email protected]>
* Bump mkdocs-material from 9.5.11 to 9.5.15 (#2008)

Bumps [mkdocs-material](https://github.com/squidfunk/mkdocs-material) from 9.5.11 to 9.5.15.
- [Release notes](https://github.com/squidfunk/mkdocs-material/releases)
- [Changelog](https://github.com/squidfunk/mkdocs-material/blob/master/CHANGELOG)
- [Commits](squidfunk/mkdocs-material@9.5.11...9.5.15)

---
updated-dependencies:
- dependency-name: mkdocs-material
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pytest from 8.0.2 to 8.1.1 (#2007)

Bumps [pytest](https://github.com/pytest-dev/pytest) from 8.0.2 to 8.1.1.
- [Release notes](https://github.com/pytest-dev/pytest/releases)
- [Changelog](https://github.com/pytest-dev/pytest/blob/main/CHANGELOG.rst)
- [Commits](pytest-dev/pytest@8.0.2...8.1.1)

---
updated-dependencies:
- dependency-name: pytest
  dependency-type: direct:development
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump ruff from 0.2.2 to 0.3.4 (#2009)

Bumps [ruff](https://github.com/astral-sh/ruff) from 0.2.2 to 0.3.4.
- [Release notes](https://github.com/astral-sh/ruff/releases)
- [Changelog](https://github.com/astral-sh/ruff/blob/main/CHANGELOG.md)
- [Commits](astral-sh/ruff@v0.2.2...v0.3.4)

---
updated-dependencies:
- dependency-name: ruff
  dependency-type: direct:development
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump uvicorn from 0.27.1 to 0.29.0 (#2012)

Bumps [uvicorn](https://github.com/encode/uvicorn) from 0.27.1 to 0.29.0.
- [Release notes](https://github.com/encode/uvicorn/releases)
- [Changelog](https://github.com/encode/uvicorn/blob/master/CHANGELOG.md)
- [Commits](encode/uvicorn@0.27.1...0.29.0)

---
updated-dependencies:
- dependency-name: uvicorn
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pymatgen from 2024.2.23 to 2024.3.1 (#2013)

Bumps [pymatgen](https://github.com/materialsproject/pymatgen) from 2024.2.23 to 2024.3.1.
- [Release notes](https://github.com/materialsproject/pymatgen/releases)
- [Changelog](https://github.com/materialsproject/pymatgen/blob/master/docs/CHANGES.md)
- [Commits](materialsproject/pymatgen@v2024.2.23...v2024.3.1)

---
updated-dependencies:
- dependency-name: pymatgen
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pydantic[email] from 2.6.2 to 2.6.4 (#2014)

Bumps [pydantic[email]](https://github.com/pydantic/pydantic) from 2.6.2 to 2.6.4.
- [Release notes](https://github.com/pydantic/pydantic/releases)
- [Changelog](https://github.com/pydantic/pydantic/blob/main/HISTORY.md)
- [Commits](pydantic/pydantic@v2.6.2...v2.6.4)

---
updated-dependencies:
- dependency-name: pydantic[email]
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump build from 1.0.3 to 1.1.1 (#2016)

Bumps [build](https://github.com/pypa/build) from 1.0.3 to 1.1.1.
- [Release notes](https://github.com/pypa/build/releases)
- [Changelog](https://github.com/pypa/build/blob/main/CHANGELOG.rst)
- [Commits](pypa/build@1.0.3...1.1.1)

---
updated-dependencies:
- dependency-name: build
  dependency-type: direct:development
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump mypy from 1.8.0 to 1.9.0 (#2017)

Bumps [mypy](https://github.com/python/mypy) from 1.8.0 to 1.9.0.
- [Changelog](https://github.com/python/mypy/blob/master/CHANGELOG.md)
- [Commits](python/mypy@v1.8.0...1.9.0)

---
updated-dependencies:
- dependency-name: mypy
  dependency-type: direct:development
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump rich from 13.7.0 to 13.7.1 (#2018)

Bumps [rich](https://github.com/Textualize/rich) from 13.7.0 to 13.7.1.
- [Release notes](https://github.com/Textualize/rich/releases)
- [Changelog](https://github.com/Textualize/rich/blob/master/CHANGELOG.md)
- [Commits](Textualize/rich@v13.7.0...v13.7.1)

---
updated-dependencies:
- dependency-name: rich
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump jarvis-tools from 2023.12.12 to 2024.3.4 (#2019)

Bumps [jarvis-tools](https://github.com/usnistgov/jarvis) from 2023.12.12 to 2024.3.4.
- [Release notes](https://github.com/usnistgov/jarvis/releases)
- [Commits](https://github.com/usnistgov/jarvis/commits)

---
updated-dependencies:
- dependency-name: jarvis-tools
  dependency-type: direct:production
  update-type: version-update:semver-major
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pre-commit from 3.6.2 to 3.7.0 (#2015)

Bumps [pre-commit](https://github.com/pre-commit/pre-commit) from 3.6.2 to 3.7.0.
- [Release notes](https://github.com/pre-commit/pre-commit/releases)
- [Changelog](https://github.com/pre-commit/pre-commit/blob/main/CHANGELOG.md)
- [Commits](pre-commit/pre-commit@v3.6.2...v3.7.0)

---
updated-dependencies:
- dependency-name: pre-commit
  dependency-type: direct:development
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
Co-authored-by: Matthew Evans <[email protected]>

* Bump pytest-cov from 4.1.0 to 5.0.0 (#2011)

Bumps [pytest-cov](https://github.com/pytest-dev/pytest-cov) from 4.1.0 to 5.0.0.
- [Changelog](https://github.com/pytest-dev/pytest-cov/blob/master/CHANGELOG.rst)
- [Commits](pytest-dev/pytest-cov@v4.1.0...v5.0.0)

---
updated-dependencies:
- dependency-name: pytest-cov
  dependency-type: direct:development
  update-type: version-update:semver-major
...

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Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
Co-authored-by: Matthew Evans <[email protected]>

* Bump mkdocstrings[python] from 0.24.0 to 0.24.1 (#2010)

Bumps [mkdocstrings[python]](https://github.com/mkdocstrings/mkdocstrings) from 0.24.0 to 0.24.1.
- [Release notes](https://github.com/mkdocstrings/mkdocstrings/releases)
- [Changelog](https://github.com/mkdocstrings/mkdocstrings/blob/main/CHANGELOG.md)
- [Commits](mkdocstrings/mkdocstrings@0.24.0...0.24.1)

---
updated-dependencies:
- dependency-name: mkdocstrings[python]
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

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Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
Co-authored-by: Matthew Evans <[email protected]>

* Update `pre-commit` hooks

* Linting

* Bump build from 1.1.1 to 1.2.1

Bumps [build](https://github.com/pypa/build) from 1.1.1 to 1.2.1.
- [Release notes](https://github.com/pypa/build/releases)
- [Changelog](https://github.com/pypa/build/blob/main/CHANGELOG.rst)
- [Commits](pypa/build@1.1.1...1.2.1)

---
updated-dependencies:
- dependency-name: build
  dependency-type: direct:development
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>

* Bump jarvis-tools from 2024.3.4 to 2024.3.30

Bumps [jarvis-tools](https://github.com/usnistgov/jarvis) from 2024.3.4 to 2024.3.30.
- [Release notes](https://github.com/usnistgov/jarvis/releases)
- [Commits](https://github.com/usnistgov/jarvis/commits/v2024.3.30)

---
updated-dependencies:
- dependency-name: jarvis-tools
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>

* Bump pymongo from 4.6.2 to 4.6.3

Bumps [pymongo](https://github.com/mongodb/mongo-python-driver) from 4.6.2 to 4.6.3.
- [Release notes](https://github.com/mongodb/mongo-python-driver/releases)
- [Changelog](https://github.com/mongodb/mongo-python-driver/blob/master/doc/changelog.rst)
- [Commits](mongodb/mongo-python-driver@4.6.2...4.6.3)

---
updated-dependencies:
- dependency-name: pymongo
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>

* Bump mkdocs-material from 9.5.11 to 9.5.16 (#2025)

* Bump mkdocs-material from 9.5.11 to 9.5.16

Bumps [mkdocs-material](https://github.com/squidfunk/mkdocs-material) from 9.5.11 to 9.5.16.
- [Release notes](https://github.com/squidfunk/mkdocs-material/releases)
- [Changelog](https://github.com/squidfunk/mkdocs-material/blob/master/CHANGELOG)
- [Commits](squidfunk/mkdocs-material@9.5.11...9.5.16)

---
updated-dependencies:
- dependency-name: mkdocs-material
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>

* Update requirements-docs.txt

* Linting

---------

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
Co-authored-by: Matthew Evans <[email protected]>
Co-authored-by: Matthew Evans <[email protected]>

---------

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
Co-authored-by: Matthew Evans <[email protected]>
Co-authored-by: Matthew Evans <[email protected]>
* Bump mkdocstrings[python] from 0.24.1 to 0.24.3 (#2028)

Bumps [mkdocstrings[python]](https://github.com/mkdocstrings/mkdocstrings) from 0.24.1 to 0.24.3.
- [Release notes](https://github.com/mkdocstrings/mkdocstrings/releases)
- [Changelog](https://github.com/mkdocstrings/mkdocstrings/blob/main/CHANGELOG.md)
- [Commits](mkdocstrings/mkdocstrings@0.24.1...0.24.3)

---
updated-dependencies:
- dependency-name: mkdocstrings[python]
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

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Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump ruff from 0.3.4 to 0.3.5 (#2029)

Bumps [ruff](https://github.com/astral-sh/ruff) from 0.3.4 to 0.3.5.
- [Release notes](https://github.com/astral-sh/ruff/releases)
- [Changelog](https://github.com/astral-sh/ruff/blob/main/CHANGELOG.md)
- [Commits](astral-sh/ruff@v0.3.4...v0.3.5)

---
updated-dependencies:
- dependency-name: ruff
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

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Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump fastapi from 0.110.0 to 0.110.1 (#2030)

Bumps [fastapi](https://github.com/tiangolo/fastapi) from 0.110.0 to 0.110.1.
- [Release notes](https://github.com/tiangolo/fastapi/releases)
- [Commits](fastapi/fastapi@0.110.0...0.110.1)

---
updated-dependencies:
- dependency-name: fastapi
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

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Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump mkdocs-material from 9.5.16 to 9.5.17 (#2031)

Bumps [mkdocs-material](https://github.com/squidfunk/mkdocs-material) from 9.5.16 to 9.5.17.
- [Release notes](https://github.com/squidfunk/mkdocs-material/releases)
- [Changelog](https://github.com/squidfunk/mkdocs-material/blob/master/CHANGELOG)
- [Commits](squidfunk/mkdocs-material@9.5.16...9.5.17)

---
updated-dependencies:
- dependency-name: mkdocs-material
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

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Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
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* Bump jarvis-tools from 2024.3.30 to 2024.4.10 (#2033)

Bumps [jarvis-tools](https://github.com/usnistgov/jarvis) from 2024.3.30 to 2024.4.10.
- [Release notes](https://github.com/usnistgov/jarvis/releases)
- [Commits](usnistgov/jarvis@v2024.3.30...v2024.4.10)

---
updated-dependencies:
- dependency-name: jarvis-tools
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

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Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump ruff from 0.3.5 to 0.3.7 (#2034)

Bumps [ruff](https://github.com/astral-sh/ruff) from 0.3.5 to 0.3.7.
- [Release notes](https://github.com/astral-sh/ruff/releases)
- [Changelog](https://github.com/astral-sh/ruff/blob/main/CHANGELOG.md)
- [Commits](astral-sh/ruff@v0.3.5...v0.3.7)

---
updated-dependencies:
- dependency-name: ruff
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pymatgen from 2024.3.1 to 2024.4.13 (#2035)

Bumps [pymatgen](https://github.com/materialsproject/pymatgen) from 2024.3.1 to 2024.4.13.
- [Release notes](https://github.com/materialsproject/pymatgen/releases)
- [Changelog](https://github.com/materialsproject/pymatgen/blob/master/docs/CHANGES.md)
- [Commits](materialsproject/pymatgen@v2024.3.1...v2024.4.13)

---
updated-dependencies:
- dependency-name: pymatgen
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump mkdocs-material from 9.5.17 to 9.5.18 (#2036)

Bumps [mkdocs-material](https://github.com/squidfunk/mkdocs-material) from 9.5.17 to 9.5.18.
- [Release notes](https://github.com/squidfunk/mkdocs-material/releases)
- [Changelog](https://github.com/squidfunk/mkdocs-material/blob/master/CHANGELOG)
- [Commits](squidfunk/mkdocs-material@9.5.17...9.5.18)

---
updated-dependencies:
- dependency-name: mkdocs-material
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump fastapi from 0.110.1 to 0.110.2 (#2038)

Bumps [fastapi](https://github.com/tiangolo/fastapi) from 0.110.1 to 0.110.2.
- [Release notes](https://github.com/tiangolo/fastapi/releases)
- [Commits](fastapi/fastapi@0.110.1...0.110.2)

---
updated-dependencies:
- dependency-name: fastapi
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump ruff from 0.3.7 to 0.4.1 (#2039)

Bumps [ruff](https://github.com/astral-sh/ruff) from 0.3.7 to 0.4.1.
- [Release notes](https://github.com/astral-sh/ruff/releases)
- [Changelog](https://github.com/astral-sh/ruff/blob/main/CHANGELOG.md)
- [Commits](astral-sh/ruff@v0.3.7...v0.4.1)

---
updated-dependencies:
- dependency-name: ruff
  dependency-type: direct:development
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump chuhlomin/render-template from 1.9 to 1.10 (#2040)

Bumps [chuhlomin/render-template](https://github.com/chuhlomin/render-template) from 1.9 to 1.10.
- [Release notes](https://github.com/chuhlomin/render-template/releases)
- [Commits](chuhlomin/render-template@v1.9...v1.10)

---
updated-dependencies:
- dependency-name: chuhlomin/render-template
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

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Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump mypy from 1.9.0 to 1.10.0 (#2041)

Bumps [mypy](https://github.com/python/mypy) from 1.9.0 to 1.10.0.
- [Changelog](https://github.com/python/mypy/blob/master/CHANGELOG.md)
- [Commits](python/mypy@1.9.0...v1.10.0)

---
updated-dependencies:
- dependency-name: mypy
  dependency-type: direct:development
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pydantic[email] from 2.6.4 to 2.7.1 (#2043)

Bumps [pydantic[email]](https://github.com/pydantic/pydantic) from 2.6.4 to 2.7.1.
- [Release notes](https://github.com/pydantic/pydantic/releases)
- [Changelog](https://github.com/pydantic/pydantic/blob/main/HISTORY.md)
- [Commits](pydantic/pydantic@v2.6.4...v2.7.1)

---
updated-dependencies:
- dependency-name: pydantic[email]
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump ruff from 0.4.1 to 0.4.2 (#2044)

Bumps [ruff](https://github.com/astral-sh/ruff) from 0.4.1 to 0.4.2.
- [Release notes](https://github.com/astral-sh/ruff/releases)
- [Changelog](https://github.com/astral-sh/ruff/blob/main/CHANGELOG.md)
- [Commits](astral-sh/ruff@v0.4.1...v0.4.2)

---
updated-dependencies:
- dependency-name: ruff
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pymongo from 4.6.3 to 4.7.0 (#2045)

Bumps [pymongo](https://github.com/mongodb/pymongo) from 4.6.3 to 4.7.0.
- [Commits](https://github.com/mongodb/pymongo/commits)

---
updated-dependencies:
- dependency-name: pymongo
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pytest from 8.1.1 to 8.2.0 (#2046)

Bumps [pytest](https://github.com/pytest-dev/pytest) from 8.1.1 to 8.2.0.
- [Release notes](https://github.com/pytest-dev/pytest/releases)
- [Changelog](https://github.com/pytest-dev/pytest/blob/main/CHANGELOG.rst)
- [Commits](pytest-dev/pytest@8.1.1...8.2.0)

---
updated-dependencies:
- dependency-name: pytest
  dependency-type: direct:development
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump mkdocstrings[python] from 0.24.3 to 0.25.0 (#2047)

Bumps [mkdocstrings[python]](https://github.com/mkdocstrings/mkdocstrings) from 0.24.3 to 0.25.0.
- [Release notes](https://github.com/mkdocstrings/mkdocstrings/releases)
- [Changelog](https://github.com/mkdocstrings/mkdocstrings/blob/main/CHANGELOG.md)
- [Commits](mkdocstrings/mkdocstrings@0.24.3...0.25.0)

---
updated-dependencies:
- dependency-name: mkdocstrings[python]
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump mkdocs from 1.5.3 to 1.6.0 (#2037)

Bumps [mkdocs](https://github.com/mkdocs/mkdocs) from 1.5.3 to 1.6.0.
- [Release notes](https://github.com/mkdocs/mkdocs/releases)
- [Commits](mkdocs/mkdocs@1.5.3...1.6.0)

---
updated-dependencies:
- dependency-name: mkdocs
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump mkdocs-material from 9.5.18 to 9.5.19 (#2042)

Bumps [mkdocs-material](https://github.com/squidfunk/mkdocs-material) from 9.5.18 to 9.5.19.
- [Release notes](https://github.com/squidfunk/mkdocs-material/releases)
- [Changelog](https://github.com/squidfunk/mkdocs-material/blob/master/CHANGELOG)
- [Commits](squidfunk/mkdocs-material@9.5.18...9.5.19)

---
updated-dependencies:
- dependency-name: mkdocs-material
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

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Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
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* Update `pre-commit` hooks

* Bump pymongo from 4.7.0 to 4.7.1 (#2050)

Bumps [pymongo](https://github.com/mongodb/mongo-python-driver) from 4.7.0 to 4.7.1.
- [Release notes](https://github.com/mongodb/mongo-python-driver/releases)
- [Changelog](https://github.com/mongodb/mongo-python-driver/blob/master/doc/changelog.rst)
- [Commits](mongodb/mongo-python-driver@4.7.0...4.7.1)

---
updated-dependencies:
- dependency-name: pymongo
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump mike from 2.0.0 to 2.1.1 (#2051)

Bumps [mike](https://github.com/jimporter/mike) from 2.0.0 to 2.1.1.
- [Release notes](https://github.com/jimporter/mike/releases)
- [Changelog](https://github.com/jimporter/mike/blob/master/CHANGES.md)
- [Commits](jimporter/mike@v2.0.0...v2.1.1)

---
updated-dependencies:
- dependency-name: mike
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump mkdocstrings[python] from 0.25.0 to 0.25.1 (#2052)

Bumps [mkdocstrings[python]](https://github.com/mkdocstrings/mkdocstrings) from 0.25.0 to 0.25.1.
- [Release notes](https://github.com/mkdocstrings/mkdocstrings/releases)
- [Changelog](https://github.com/mkdocstrings/mkdocstrings/blob/main/CHANGELOG.md)
- [Commits](mkdocstrings/mkdocstrings@0.25.0...0.25.1)

---
updated-dependencies:
- dependency-name: mkdocstrings[python]
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump fastapi from 0.110.2 to 0.111.0 (#2054)

Bumps [fastapi](https://github.com/tiangolo/fastapi) from 0.110.2 to 0.111.0.
- [Release notes](https://github.com/tiangolo/fastapi/releases)
- [Commits](fastapi/fastapi@0.110.2...0.111.0)

---
updated-dependencies:
- dependency-name: fastapi
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump ruff from 0.4.2 to 0.4.3 (#2055)

Bumps [ruff](https://github.com/astral-sh/ruff) from 0.4.2 to 0.4.3.
- [Release notes](https://github.com/astral-sh/ruff/releases)
- [Changelog](https://github.com/astral-sh/ruff/blob/main/CHANGELOG.md)
- [Commits](astral-sh/ruff@v0.4.2...v0.4.3)

---
updated-dependencies:
- dependency-name: ruff
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pymatgen from 2024.4.13 to 2024.5.1 (#2056)

Bumps [pymatgen](https://github.com/materialsproject/pymatgen) from 2024.4.13 to 2024.5.1.
- [Release notes](https://github.com/materialsproject/pymatgen/releases)
- [Changelog](https://github.com/materialsproject/pymatgen/blob/master/docs/CHANGES.md)
- [Commits](materialsproject/pymatgen@v2024.4.13...v2024.5.1)

---
updated-dependencies:
- dependency-name: pymatgen
  dependency-type: direct:production
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump mkdocs-material from 9.5.19 to 9.5.22 (#2058)

Bumps [mkdocs-material](https://github.com/squidfunk/mkdocs-material) from 9.5.19 to 9.5.22.
- [Release notes](https://github.com/squidfunk/mkdocs-material/releases)
- [Changelog](https://github.com/squidfunk/mkdocs-material/blob/master/CHANGELOG)
- [Commits](squidfunk/mkdocs-material@9.5.19...9.5.22)

---
updated-dependencies:
- dependency-name: mkdocs-material
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pymongo from 4.7.1 to 4.7.2 (#2059)

Bumps [pymongo](https://github.com/mongodb/mongo-python-driver) from 4.7.1 to 4.7.2.
- [Release notes](https://github.com/mongodb/mongo-python-driver/releases)
- [Changelog](https://github.com/mongodb/mongo-python-driver/blob/master/doc/changelog.rst)
- [Commits](mongodb/mongo-python-driver@4.7.1...4.7.2)

---
updated-dependencies:
- dependency-name: pymongo
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pre-commit from 3.7.0 to 3.7.1 (#2060)

Bumps [pre-commit](https://github.com/pre-commit/pre-commit) from 3.7.0 to 3.7.1.
- [Release notes](https://github.com/pre-commit/pre-commit/releases)
- [Changelog](https://github.com/pre-commit/pre-commit/blob/main/CHANGELOG.md)
- [Commits](pre-commit/pre-commit@v3.7.0...v3.7.1)

---
updated-dependencies:
- dependency-name: pre-commit
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump ruff from 0.4.3 to 0.4.4 (#2061)

Bumps [ruff](https://github.com/astral-sh/ruff) from 0.4.3 to 0.4.4.
- [Release notes](https://github.com/astral-sh/ruff/releases)
- [Changelog](https://github.com/astral-sh/ruff/blob/main/CHANGELOG.md)
- [Commits](astral-sh/ruff@v0.4.3...v0.4.4)

---
updated-dependencies:
- dependency-name: ruff
  dependency-type: direct:development
  update-type: version-update:semver-patch
...

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Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Update OpenAPI schemas

---------

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
Co-authored-by: Matthew Evans <[email protected]>
Co-authored-by: Matthew Evans <[email protected]>
* Bump mkdocs-material from 9.5.22 to 9.5.23 (#2062)

Bumps [mkdocs-material](https://github.com/squidfunk/mkdocs-material) from 9.5.22 to 9.5.23.
- [Release notes](https://github.com/squidfunk/mkdocs-material/releases)
- [Changelog](https://github.com/squidfunk/mkdocs-material/blob/master/CHANGELOG)
- [Commits](squidfunk/mkdocs-material@9.5.22...9.5.23)

---
updated-dependencies:
- dependency-name: mkdocs-material
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Bump pytest from 8.2.0 to 8.2.1 (#2063)

Bumps [pytest](https://github.com/pytest-dev/pytest) from 8.2.0 to 8.2.1.
- [Release notes](https://github.com/pytest-dev/pytest/releases)
- [Changelog](https://github.com/pytest-dev/pytest/blob/main/CHANGELOG.rst)
- [Commits](pytest-dev/pytest@8.2.0...8.2.1)

---
updated-dependencies:
- dependency-name: pytest
  dependency-type: direct:development
  update-type: version-update:semver-patch
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Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>

* Update `pre-commit` hooks

* Silence internal pytest warning

* Remove spurious warning again

* Bump requests from 2.31.0 to 2.32.3

Bumps [requests](https://github.com/psf/requests) from 2.31.0 to 2.32.3.
- [Release notes](https://github.com/psf/requests/releases)
- [Changelog](https://github.com/psf/requests/blob/main/HISTORY.md)
- [Commits](psf/requests@v2.31.0...v2.32.3)

---
updated-dependencies:
- dependency-name: requests
  dependency-type: direct:production
  update-type: version-update:semver-minor
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Signed-off-by: dependabot[bot] <[email protected]>

* Bump mkdocs-material from 9.5.23 to 9.5.25

Bumps [mkdocs-material](https://github.com/squidfunk/mkdocs-material) from 9.5.23 to 9.5.25.
- [Release notes](https://github.com/squidfunk/mkdocs-material/releases)
- [Changelog](https://github.com/squidfunk/mkdocs-material/blob/master/CHANGELOG)
- [Commits](squidfunk/mkdocs-material@9.5.23...9.5.25)

---
updated-dependencies:
- dependency-name: mkdocs-material
  dependency-type: direct:production
  update-type: version-update:semver-patch
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Signed-off-by: dependabot[bot] <[email protected]>

* Bump ase from 3.22.1 to 3.23.0

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updated-dependencies:
- dependency-name: ase
  dependency-type: direct:production
  update-type: version-update:semver-minor
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Signed-off-by: dependabot[bot] <[email protected]>

* Bump pydantic[email] from 2.7.1 to 2.7.2

Bumps [pydantic[email]](https://github.com/pydantic/pydantic) from 2.7.1 to 2.7.2.
- [Release notes](https://github.com/pydantic/pydantic/releases)
- [Changelog](https://github.com/pydantic/pydantic/blob/main/HISTORY.md)
- [Commits](pydantic/pydantic@v2.7.1...v2.7.2)

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- dependency-name: pydantic[email]
  dependency-type: direct:production
  update-type: version-update:semver-patch
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* Bump ruff from 0.4.4 to 0.4.7

Bumps [ruff](https://github.com/astral-sh/ruff) from 0.4.4 to 0.4.7.
- [Release notes](https://github.com/astral-sh/ruff/releases)
- [Changelog](https://github.com/astral-sh/ruff/blob/main/CHANGELOG.md)
- [Commits](astral-sh/ruff@v0.4.4...v0.4.7)

---
updated-dependencies:
- dependency-name: ruff
  dependency-type: direct:development
  update-type: version-update:semver-patch
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* Bump uvicorn from 0.29.0 to 0.30.1

Bumps [uvicorn](https://github.com/encode/uvicorn) from 0.29.0 to 0.30.1.
- [Release notes](https://github.com/encode/uvicorn/releases)
- [Changelog](https://github.com/encode/uvicorn/blob/master/CHANGELOG.md)
- [Commits](encode/uvicorn@0.29.0...0.30.1)

---
updated-dependencies:
- dependency-name: uvicorn
  dependency-type: direct:production
  update-type: version-update:semver-minor
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---------

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
Co-authored-by: Matthew Evans <[email protected]>
Add new space group fields and outline tests

Use constr for pydantic v1 instead of field regexp

Remove space from regexp

Fix outstanding discrepancies with specification

Update test with new number of properties
@ml-evs ml-evs force-pushed the ml-evs/add_space_group_support branch from 0480e57 to 2033b86 Compare June 11, 2024 14:47
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Support for space group definitions
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