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HpParser: fix q-points/atoms output corner case #64

Merged
merged 2 commits into from
Feb 13, 2024
Merged

HpParser: fix q-points/atoms output corner case #64

merged 2 commits into from
Feb 13, 2024

Commits on Feb 13, 2024

  1. HpParser: fix q-points/atoms output test case 

    The current raw output parser would miss some corner cases,
when lots of q-points are generated and the number has no more
any space left from the parenthesis.
The solution is to use a more general regex search. As a sanity
check, also the perturbed atom number sites regex search is
changed correspondingly.
    @bastonero
    bastonero committed Feb 13, 2024
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  2. Merge branch 'master' of https://github.com/aiidateam/aiida-quantumes… 

    …presso-hp into fix/parsing
    @bastonero
    bastonero committed Feb 13, 2024
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