FAIRmat-NFDI / nomad-parser-plugins-simulation / 29024750646

76%

develop: 76%

Build Type

Pull #170

github

Committed by ndaelman-hu

Commit Message

Reattach MPCDF registry as the primary package index

The MPCDF GitLab registry was removed as index in ecbdc25 after CI hit
errors resolving from it, but that was a transient registry downage. Public
PyPI only carries stable nomad-lab (<=1.4.2), which lacks the mapping-parser
fixes that the CHGCAR `update_mode='append'` relies on, so `test_chgcar`
fails there. The MPCDF registry carries the nomad-lab pre-releases with those
fixes (1.4.3.dev/rc). Restoring it as the primary index lets the declarative
charge-density mapping work again, matching develop's resolution.

Verified: installing via the MPCDF index resolves nomad-lab 1.4.3rc1 and the
full VASP suite (incl. test_chgcar) passes with the declarative convert.

Pull Request Pull Request #170: Migration of fundamental system and electronic properties for normalization to results

Coverage Stats

1360 of 1971 new or added lines in 40 files covered. (69.0%)

23 existing lines in 8 files now uncovered.

10250 of 13507 relevant lines covered (75.89%)

0.76 hits per line