Code

DFT calculator convergence test#292

Code

Merged

bernstei merged 5 commits intomainlibAtoms/workflow:mainfrom dft_SCF_convergence_statuslibAtoms/workflow:dft_SCF_convergence_statusCopy head branch name to clipboardFeb 8, 2024

+58-15

Commits

Commits on Feb 7, 2024

• Change the way calculator results copying checks for DFT calculator

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• Increment version

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Commits on Feb 8, 2024

• Replace tests that use generic calculator with EMT() objects with

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• Tweak timing of job in test_resubmit_killed_jobs for github CI

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• Tweak do_resubmit_killed_jobs task size

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