[CP2K-user] [CP2K:18675] [CP2K] &GEO_OPT→BFGS →TRUST_RADIUS different from the input and output

[lingd5805@gamil.com]

Hello everyone, when cp2k does GEO_OPT, the displacement in BFGS, why is 
the input and output different? In this case, how should I control the 
movement step of the atom?
grep "RADIUS" cp2k.inp
          TRUST_RADIUS     0.2
 grep " Trust radius:" cp2k.out
          BFGS| Trust radius:      0.378


Any feedback would be much appreciated! Thanks for taking a look at my 
issues. 

With much appreciation, 

lingd

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