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More examples in documentation#198

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martin-schlipf wants to merge 18 commits intomastervasp-dev/py4vasp:masterfrom more_examples_in_documentationvasp-dev/py4vasp:more_examples_in_documentationCopy head branch name to clipboard

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Commits on Feb 27, 2025

• Do not use abbreviations in examples

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• Add more examples and documentation for Calculation class

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• Add documentation for projectors

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• Update documentation for band structure

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Commits on Feb 28, 2025

• Make projections consistent between band and dos

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• Add additional documentation for DOS class

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• Implement small routine to create HDF5 file

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• Add unit test for examples in documentation

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• Fix doctests for py4vasp.calculation

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• Make Calculation doctest pass

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Commits on Mar 3, 2025

• Merge branch 'master' into more_examples_in_documentation

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• Remove extraneous print statement

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• Get selections for DOS

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• Make examples at class level of DOS pass

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• Fix eaxmples for dos.to_graph

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• Fix dos.to_frame examples

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• Fix remaining DOS examples (to_dict)

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• WIP: fix band examples

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