[CP2K-user] GEO_OPT and CELL_OPT difference

sumit agrawal sumitag... at gmail.com
Thu May 13 08:04:36 UTC 2021

Hi everyone,

What is the difference between RUN TYPE: GEO_OPT and CELL_OPT ? Since both
are doing optimization.

Can we do GEO_OPT for crystal lattice ?

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