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labels.json format #28

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eimrek opened this issue Mar 16, 2023 · 0 comments
Open

labels.json format #28

eimrek opened this issue Mar 16, 2023 · 0 comments

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@eimrek
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eimrek commented Mar 16, 2023

Proposed format update for acwf_paper_plots/code-data/labels.json

demo:

{
    "references":
    {
        "all-electron average":
        {
            "oxides": "results-oxides-verification-PBE-v1-AE-average.json",
            "unaries": "results-unaries-verification-PBE-v1-AE-average.json"
        }
    },
    "methods":
    {
        "ABINIT":{
            "oxides": "results-oxides-verification-PBE-v1-abinit-PseudoDojo-0.5b1-PBE-SR-standard-psp8.json",
            "unaries": "results-unaries-verification-PBE-v1-abinit-PseudoDojo-0.5b1-PBE-SR-standard-psp8.json",
            "code_label": "ABINIT",
            "basis_set_label": "PW".
            "pseudo_label": "PseudoDojo-v0.5b",
            "is_main": true
        },
        ...
    }
}    

Comments:

  • The dictionary key of each method is the short_label, e.g. "ABINIT".
  • code, basis set and pseudopotential labels are separated into 3 separate keys.
  • The separate dictionaries methods-main and methods-supplementary are merged into one (methods) and the key is_main determines if an entry is main or supplementary.
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