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FAIRmat-NFDI / nomad-simulations / 36885092487
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Build:
DEFAULT BRANCH: develop
Ran 01 Oct 2026 03:33PM UTC
Jobs 5
Files 134
Run time 1min
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01 Oct 2026 03:32PM UTC coverage: 87.362% (+0.007%) from 87.355%
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Restrict `contributions` to `HamiltonianTerm`; separate out `relativity` (#501)

Add `HamiltonianTerm` as the base for additive Hamiltonian terms and retype
`ModelMethod.contributions` to it, so a full method can no longer nest inside
its own `contributions` — removing the recursive self-nesting artifact that
`.@` mapping-parser annotations produced. Rebase the term classes
(`ImplicitSolvationModel`, `EmpiricalDispersionModel`, `SelfInteractionCorrection`,
`HubbardInteractions`, `NonlocalCorrelation`, and force-field `Potential`) onto
`HamiltonianTerm`.

`RelativityModel` stays as the typed `ModelMethodElectronic.relativity`
subsection — it transforms the Hamiltonian rather than adding a separable term.
`numerical_settings` remains on `BaseModelMethod` so methods and terms alike
keep their own.

Closes #324.

42 of 42 new or added lines in 4 files covered. (100.0%)

10404 of 11909 relevant lines covered (87.36%)

4.37 hits per line

Jobs
ID Job ID Ran Files Coverage
1 36885092487.1 01 Oct 2026 03:33PM UTC 134
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2 36885092487.2 01 Oct 2026 03:33PM UTC 134
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3 36885092487.3 01 Oct 2026 03:33PM UTC 134
87.36
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4 36885092487.4 01 Oct 2026 03:34PM UTC 134
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5 36885092487.5 01 Oct 2026 03:34PM UTC 134
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Source Files on build 36885092487
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