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Added ThinFilmCombinatorialSample with properties #111

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merged 5 commits into from
Oct 11, 2024

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hampusnasstrom
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@hampusnasstrom hampusnasstrom self-assigned this Oct 2, 2024
@hampusnasstrom hampusnasstrom linked an issue Oct 2, 2024 that may be closed by this pull request
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@RoteKekse and @tunold I now added the ThinFilmCombinatoriSample class with the properties we discussed. Please let me know what you think.

@ka-sarthak could you review it from Area A side?

@Pepe-Marquez just FYI :)

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@ka-sarthak ka-sarthak left a comment

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Looks great to me. The schemas are well-defined. I added some suggestions related to quantity descriptions and units.

Also, you are defining the units for wavelength as nm. It's completely fine but if we want to be consistent with using SI for quantity definitions, we might want to change it to m.

src/nomad_material_processing/combinatorial.py Outdated Show resolved Hide resolved
type=float,
description="""
The peak area of the photoluminescence spectrum.
""",
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Shouldn't units be defined for peak_area since we have quantities with units on at least x-axis (wavelength, or energy in general, I assume)?

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not sure what the correct unit is, if it is wavelength over intensity, i think leaving it like this is ok

@RoteKekse RoteKekse merged commit 212994c into main Oct 11, 2024
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@RoteKekse RoteKekse deleted the 103-add-specialized-combinatorialsample-schema branch October 11, 2024 10:20
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@RoteKekse @ka-sarthak why is this merged in main ? ?

@Pepe-Marquez
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@RoteKekse @ka-sarthak why is this merged in main ? ?

Why not? Do you see any fundamental problems?

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This will be revised anyhow next week as we are testing the combo classes now in the HTEM database and other group plugins.

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it was not revised by everyone before merging.. it could live in one of that plugins i believe

@RoteKekse
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hampus made it and sarthak and me reviewed it

@RoteKekse
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and i then merged it

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This will be revised next week.

@FAIRmat-NFDI FAIRmat-NFDI deleted a comment from RoteKekse Oct 18, 2024
@hampusnasstrom hampusnasstrom restored the 103-add-specialized-combinatorialsample-schema branch October 21, 2024 11:34
hampusnasstrom added a commit that referenced this pull request Oct 21, 2024
hampusnasstrom added a commit that referenced this pull request Oct 21, 2024
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Add specialized CombinatorialSample schema
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