Protocol: renew protocol according to Nicola and Flav's suggestion - Githubissues

aiidateam / aiida-sssp-workflow

sssp verification workflows

MIT License

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Protocol: renew protocol according to Nicola and Flav's suggestion #169

Closed unkcpz closed 2 years ago

unkcpz commented 2 years ago

FD with smearing width 0.0045 for all calculations.
delta criteria on absolute diff.
band structure kpoints distance set to 0.025