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Add i-PI server calculator and update i-PI driver to AB v0.4 #31

Merged
merged 10 commits into from
Sep 19, 2024
Merged

Add i-PI server calculator and update i-PI driver to AB v0.4 #31

merged 10 commits into from
Sep 19, 2024

Commits on Sep 16, 2024

  1. driver update

    @tjjarvinen
    tjjarvinen committed Sep 16, 2024
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  2. initial server draft

    @tjjarvinen
    tjjarvinen committed Sep 16, 2024
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Commits on Sep 17, 2024

  1. AtomsCalculators interface and some fixes

    @tjjarvinen
    tjjarvinen committed Sep 17, 2024
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Commits on Sep 18, 2024

  1. ipi server working

    @tjjarvinen
    tjjarvinen committed Sep 18, 2024
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  2. fixes

    @tjjarvinen
    tjjarvinen committed Sep 18, 2024
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  3. tests

    @tjjarvinen
    tjjarvinen committed Sep 18, 2024
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Commits on Sep 19, 2024

  1. update tests

    @tjjarvinen
    tjjarvinen committed Sep 19, 2024
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  2. fix unixsocket

    @tjjarvinen
    tjjarvinen committed Sep 19, 2024
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  3. add doc string for server

    @tjjarvinen
    tjjarvinen committed Sep 19, 2024
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  4. fix

    @tjjarvinen
    tjjarvinen committed Sep 19, 2024
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