[Q-e-developers] New test-suite base on testcode

[Filippo Spiga]

Dear QE Developers,

Here: http://filippospiga.info/test-suite_v0.9.tar.gz

you can download a completely revisited test-suite to cover numerical regression tests for PW and CP based on the initial scripts. You can grab this 0.9 version, untar it into your QE root directory and run the test cases. Improvement will come, both in term of functionalities covered and better matching "test output " versus "pre-computed reference". Documentation is on its way as well (coding first). 

At some point in the future, when my time allows, test-suite will integrate with build-bot infrastructure allowing to automatize test scheduling and test reports. GPU-accelerated QE based on v5.1.2 will include test-suite only and not "PW/test" and "CPV/tests"

Feedbacks are very appreciated, both from a usability point of view and about test correctness. If you think something is wrong, please follow-up with me and Paolo Giannozzi on this email thread. We still have to identify which compiler is the one that generates the perfect bug-free full-correct reference outputs.

Cheers,
Filippo

--
Mr. Filippo SPIGA, M.Sc.
Quantum ESPRESSO Foundation
http://filippospiga.info ~ skype: filippo.spiga

«Nobody will drive us out of Cantor's paradise.» ~ David Hilbert

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