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Release v1.3.1 #37

Merged
merged 23 commits into from
Feb 21, 2024
Merged

Release v1.3.1 #37

merged 23 commits into from
Feb 21, 2024

Commits on Sep 25, 2022

  1. added ecp functionality

    @wladerer
    wladerer authored Sep 25, 2022
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Commits on Oct 6, 2022

  1. Merge pull request #27 from wladerer/main 

    added ecp functionality
    @gpetretto
    gpetretto authored Oct 6, 2022
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  2. add macos folders to gitignore

    @gpetretto
    gpetretto committed Oct 6, 2022
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  3. more options for setting basis

    @gpetretto
    gpetretto committed Oct 6, 2022
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  4. Merge remote-tracking branch 'upstream/ecp' into develop

    @gpetretto
    gpetretto committed Oct 6, 2022
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Commits on Oct 7, 2022

  1. ecp tests and updates

    @gpetretto
    gpetretto committed Oct 7, 2022
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  2. fix linting

    @gpetretto
    gpetretto committed Oct 7, 2022
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Commits on Jan 23, 2023

  1. add raises regex match

    @gpetretto
    gpetretto committed Jan 23, 2023
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  2. update flake8

    @gpetretto
    gpetretto committed Jan 23, 2023
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  3. fix pre-commit and linting

    @gpetretto
    gpetretto committed Jan 23, 2023
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  4. more linting

    @gpetretto
    gpetretto committed Jan 23, 2023
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  5. fix fmt parameter to comply with pymatgen new convention

    @gpetretto
    gpetretto committed Jan 23, 2023
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Commits on Jan 26, 2023

  1. Merge pull request #29 from gpetretto/develop 

    updates and tests
    @gpetretto
    gpetretto authored Jan 26, 2023
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Commits on Jan 27, 2023

  1. Merge pull request #34 from Matgenix/ecp 

    Ecp option and other updates
    @gpetretto
    gpetretto authored Jan 27, 2023
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Commits on Jan 30, 2023

  1. Updated version and documentation for 1.3.1 release.

    @davidwaroquiers
    davidwaroquiers committed Jan 30, 2023
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  2. Update version of isort in .pre-commit-config 

    This is to solve an issue with poetry config that is used in isort.
    @davidwaroquiers
    davidwaroquiers authored Jan 30, 2023
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Commits on Jun 13, 2023

  1. Update pyproject.toml 

    Changed requirement on pymatgen version.
    @davidwaroquiers
    davidwaroquiers authored Jun 13, 2023
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Commits on Feb 20, 2024

  1. Update pyproject.toml 

    Updated monty's dependency
    @davidwaroquiers
    davidwaroquiers authored Feb 20, 2024
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  2. Fixed comparison in test_files.

    @davidwaroquiers
    davidwaroquiers committed Feb 20, 2024
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  3. Fixed comparison utility function for tests.

    @davidwaroquiers
    davidwaroquiers committed Feb 20, 2024
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Commits on Feb 21, 2024

  1. Linting.

    @davidwaroquiers
    davidwaroquiers committed Feb 21, 2024
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  2. Fixed import error of plotting function from pymatgen for py3.9+.

    @davidwaroquiers
    davidwaroquiers committed Feb 21, 2024
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  3. Updated docs html.

    @davidwaroquiers
    davidwaroquiers committed Feb 21, 2024
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