v0.1.1

What's Changed

• Add kwarg on_isolated_atoms: ignore | warn | error = error to CrystalGraphConverter.forward() by @janosh in #1
• ruff + pre-commit by @janosh in #2
• Report CHGNet device by @janosh in #3
• Tests by @janosh in #4
• Style, docstring and minor edits by @lbluque in #5
• Refactor package setup by @janosh in #6
• Use future type annotations by @janosh in #7
• Packaging with pyproject.toml only by @lbluque in #8
• Test CHGNet keyword combinations by @janosh in #9
• Add test for predict_structure() by @janosh in #11
• cleanup graph classes by @lbluque in #12
• Add test_graph.py by @janosh in #13
• Crystaltoolkit Relaxation Viewer by @janosh in #14
• Relax viewer show dft energy by @janosh in #15
• Plot force in Crystal Toolkit relaxation viewer by @janosh in #16
• StructureData types and docs by @janosh in #17
• Fix use_device not set correctly by @janosh in #18
• Add readme table with "Open in Colab" badges for example notebooks by @janosh in #19
• Add cell that installs CHGNet on Colab to example notebooks by @janosh in #20
• Fix typo in filename tests/test_(crytalgraph -> crystal_graph).py by @janosh in #21
• Use urllib to read example structure from GitHub raw URL if local file not found by @janosh in #22
• Add tests/test_encoders.py by @janosh in #23
• Add tests/test_converter.py by @janosh in #24

Full Changelog: v0.0.01...v0.1.01