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Map ORCA geometry optimization to the archive (currently single-point only)
good first issueGood for newcomersGood for newcomersStatus: Open.#226 In FAIRmat-NFDI/nomad-parser-plugins-simulation;Self-tests for the additive-output harness: failure-mode properties
enhancementNew feature or requestNew feature or requestgood first issueGood for newcomersGood for newcomersStatus: Open.#225 In FAIRmat-NFDI/nomad-parser-plugins-simulation;Derive additive-output fixtures from a single source shared with the integration tests
enhancementNew feature or requestNew feature or requestgood first issueGood for newcomersGood for newcomersStatus: Open.#224 In FAIRmat-NFDI/nomad-parser-plugins-simulation;ORCA parser: adopt shared test suites and collapse the transformer navigation layer
enhancementNew feature or requestNew feature or requestStatus: Open.#220 In FAIRmat-NFDI/nomad-parser-plugins-simulation;- Status: Open.
FHI-aims: electronic_band_gaps annotation has no get_band_gaps transformer (band gap never populated)
enhancementNew feature or requestNew feature or requestStatus: Open.#206 In FAIRmat-NFDI/nomad-parser-plugins-simulation;- Status: Open.
- Status: Open.#201 In FAIRmat-NFDI/nomad-parser-plugins-simulation;
- Status: Open.#197 In FAIRmat-NFDI/nomad-parser-plugins-simulation;
- Status: Open.#194 In FAIRmat-NFDI/nomad-parser-plugins-simulation;
- Status: Open.#193 In FAIRmat-NFDI/nomad-parser-plugins-simulation;
- Status: Open.#192 In FAIRmat-NFDI/nomad-parser-plugins-simulation;