Update HSE examples, reduce the testing time, modify some outputs for HSE and LR calculations, reformat the output atomic positions, change 'jd' files in integreate tests to 'README' files #6182
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… velocties are printed out separately
mohanchen
added
EXX and lr-TDDFT
mohanchen
changed the title
mohanchen
changed the title
Critsium-xy
approved these changes
May 2, 2025
Cstandardlib
previously requested changes
May 3, 2025
ErjieWu
reviewed
May 3, 2025
ErjieWu
approved these changes
May 3, 2025
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ErjieWu
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Standardizes the code style very well, LGTM.
mohanchen
dismissed
Cstandardlib’s stale review
Some other tests will be refactored in the future
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Some major updates to make a better integrate test: Update HSE examples, reduce the testing time (continues reducing the time from over 30mins to 22 mins now), modify some outputs for HSE and LR calculations, reformat the output atomic positions, change 'jd' files in integreate tests to 'README' files