[Wien] convergence velocity
yxl@email.jlu.edu.cn
yxl at email.jlu.edu.cn
Thu Sep 6 13:25:18 CEST 2007
Dear users,
I'm doing the same calculation(all input files are the same) simultaneously on my personal computer(single core) and a pc cluster(k-points parellization). I expect the
convergence velocity should be the same, i.e. the ':DIS' in each iteration should be the same. But their convergence are different, in first iterations are the same, but later they are different completely. I wonder whether this situation is normal.
Your suggestions will be appreciated.
yours sincerely,
hongxia
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