[CP2K-user] More Detailed explanation of TARGET_LIMIT and what's the different with TARGET

Ke Zhou zhouk... at gmail.com
Tue Nov 27 14:34:11 UTC 2018


Dear all, 

In the manual, it explains as follow,

TARGET_LIMIT {Real}
Specifies the limit of the growth of the target value of the constrained 
collective variable. By default, no limit at the colvar growth is set.
This keyword cannot be repeated and it expects precisely one real.
Default unit: [internal_cp2k]

It's the limit of target. So, what's the difference with TARGET?

Here I have another question, if the TARGET_GROWTH is set a non-zero value 
and when the colvar value are more than the TARGET after running for period 
of time, will the colvar keep the TARGET or still increase?


Best,
Justin
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