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Improve to_converged #154

Merged
merged 40 commits into from
Apr 23, 2024
Merged

Improve to_converged #154

merged 40 commits into from
Apr 23, 2024

Commits on Aug 1, 2023

  1. Convert a Series to a frame through the to_frame method in Series

    @sudarshanv01
    sudarshanv01 committed Aug 1, 2023
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  2. Implement to_frame for sequence of series

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    sudarshanv01 committed Aug 1, 2023
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  3. Alter to_frame to allow it to take in multiple y-inputs

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    sudarshanv01 committed Aug 1, 2023
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  4. Refactor to_frame

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    sudarshanv01 committed Aug 1, 2023
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  5. Add width to series

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    sudarshanv01 committed Aug 1, 2023
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Commits on Aug 2, 2023

  1. assert in to_frame that the dimension of weight and y is the same

    @sudarshanv01
    sudarshanv01 committed Aug 2, 2023
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  2. Allow different length series to to_frame

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    sudarshanv01 committed Aug 2, 2023
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  3. Create the to_csv method

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    sudarshanv01 committed Aug 2, 2023
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  4. Implement to_csv method in the Mixin class

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    sudarshanv01 committed Aug 2, 2023
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Commits on Aug 3, 2023

  1. Add to_csv and to_frame to the Mixin class

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    sudarshanv01 committed Aug 3, 2023
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  2. Apply black and isort

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    sudarshanv01 committed Aug 3, 2023
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  3. Added not_core to tests needing pandas

    @sudarshanv01
    sudarshanv01 committed Aug 3, 2023
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  4. black and isort code formatting

    @sudarshanv01
    sudarshanv01 committed Aug 3, 2023
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  5. Added more not_core to graph tests

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    sudarshanv01 committed Aug 3, 2023
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  6. Change resolve to absolute when getting absolute path for mixin tests

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    sudarshanv01 committed Aug 3, 2023
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  7. Added documentation for the and methods

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    sudarshanv01 committed Aug 3, 2023
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  8. Update developer depedencies with ipykernel

    @sudarshanv01
    sudarshanv01 committed Aug 3, 2023
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  9. Merge branch 'vasp-dev:master' into master

    @sudarshanv01
    sudarshanv01 authored Aug 3, 2023
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  10. Allow install github actions to run on pull requests

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    sudarshanv01 committed Aug 3, 2023
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  11. Merge branch 'master' of github.com:sudarshanv01/py4vasp

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    sudarshanv01 committed Aug 3, 2023
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  12. Added pip installation of ipykernel into install.yaml

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    sudarshanv01 committed Aug 3, 2023
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  13. Merge branch 'vasp-dev:master' into master

    @sudarshanv01
    sudarshanv01 authored Aug 3, 2023
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  14. add pre-commit-config.yaml and pre-commit as a dependency

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    sudarshanv01 committed Aug 3, 2023
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  15. Merge branch 'master' of github.com:sudarshanv01/py4vasp

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    sudarshanv01 committed Aug 3, 2023
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Commits on Sep 10, 2023

  1. Merge branch 'master' of github.com:vasp-dev/py4vasp

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    sudarshanv01 committed Sep 10, 2023
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Commits on Sep 25, 2023

  1. Merge branch 'master' of github.com:vasp-dev/py4vasp

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    sudarshanv01 committed Sep 25, 2023
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Commits on Oct 4, 2023

  1. Merge branch 'master' of github.com:vasp-dev/py4vasp

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    sudarshanv01 committed Oct 4, 2023
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Commits on Feb 2, 2024

  1. Merge branch 'master' of github.com:vasp-dev/py4vasp

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    sudarshanv01 committed Feb 2, 2024
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Commits on Feb 4, 2024

  1. Merge branch 'master' of github.com:vasp-dev/py4vasp

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    sudarshanv01 committed Feb 4, 2024
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Commits on Feb 23, 2024

  1. Merge branch 'master' of github.com:vasp-dev/py4vasp

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    sudarshanv01 committed Feb 23, 2024
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  2. Change the oszicar format using labels

    @sudarshanv01
    sudarshanv01 committed Feb 23, 2024
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Commits on Mar 17, 2024

  1. change b to utf-8

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    sudarshanv01 committed Mar 17, 2024
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Commits on Mar 22, 2024

  1. Implement __str__ method for OSZICAR

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    sudarshanv01 committed Mar 22, 2024
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Commits on Mar 24, 2024

  1. add is_converged for the electronic steps

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    sudarshanv01 committed Mar 24, 2024
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Commits on Apr 19, 2024

  1. pass is_elmin_converged instead of inferring convergence

    @sudarshanv01
    sudarshanv01 committed Apr 19, 2024
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  2. modify tests for OSZICAR

    @sudarshanv01
    sudarshanv01 committed Apr 19, 2024
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Commits on Apr 22, 2024

  1. move test to testing for integer

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    sudarshanv01 committed Apr 22, 2024
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Commits on Apr 23, 2024

  1. test for selection exception

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    sudarshanv01 committed Apr 23, 2024
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  2. flatten converged list

    @sudarshanv01
    sudarshanv01 committed Apr 23, 2024
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  3. Test slice

    @sudarshanv01
    sudarshanv01 committed Apr 23, 2024
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