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why i cann't converge ?


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  • From: coldwind1978@yahoo.com.cn
  • To: forum@abinit.org
  • Subject: why i cann't converge ?
  • Date: Thu, 13 Oct 2005 06:53:21 +0200

i want to perform response function caculation. the program stop due to lack
convergence.but i use the same parameters i have caculate DOS and
ploarization.
i should how to do it?
the error is as follows:
scfcge : ERROR -
Potential-based CG line minimization not converged after 13 restarts.
Action : read the eventual warnings about lack of convergence.
Some might be relevant. Otherwise, raise nband.
-P-0000
-P-0000 leave_new : decision taken to exit ....

Regards

zhuzhenye


  • why i cann't converge ?, coldwind1978, 10/13/2005

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