[CP2K-user] [CP2K:17657] Use small cell for supercell guess?
mdsimula...@gmail.com
mdsimulationgroup at gmail.com
Mon Sep 12 18:33:53 UTC 2022
Hello,
Is it possible to converge an SCF for a small unit cell and then use that
as the guess for a supercell?
Thanks,
Frank
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