FAIRmat-NFDI / nomad-simulations / 37816846691

88%

Build Type

push

github

Committed by web-flow

Commit Message

Resolve SCF convergence targets against each task output (#510)

* Fix SCF convergence output resolution (#509)

Resolve relative convergence paths against each task linked output
instead of always using the final workflow output.

Add option to pass task instead of archive to the
convergence normalizer.

* Fix array check for the convergence values

*  Fix convergence aggregation: 
distinguish "undetermined" from "converged" for is_single_point_converged for GO

Coverage Stats

52 of 53 new or added lines in 3 files covered. (98.11%)

1 existing line in 1 file now uncovered.

10487 of 11977 relevant lines covered (87.56%)

4.38 hits per line