Geometry optimization with fixed ratio between lattice parameters
Francesco Ambrosio
francesco... at epfl.ch
Tue Oct 27 11:01:38 UTC 2015
Hello everybody,
I would like to know if it is possible in cp2k to perform a cell
optimization keeping fixed the ratio a/c between the lattice parameters.
I have looked in the cp2k reference manual but I could not find anything.
Thanks for your attention
Best Regards
Francesco Ambrosio
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