[CP2K-user] PRESSURE TOLERANCE problems when doing cell opt with strain on 2D slab

[Dragon Don]

Hi everyone！

  Now, I am doing a cell opt with strain by fixing the cell size, while 
there is a problem that the pressure tolerance can not converge. Could you 
please give me a hand, looking forward for your help!

  ps. The pics below are the part of the input and output,respectively.

 Don[image: QQ截图20210711202005.png][image: QQ截图20210711202109.png]
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