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by mxiangying
Sun Dec 15, 2013 11:45 am
Forum: VTSTTools
Topic: SS-NEB error report
Replies: 1
Views: 9941

SS-NEB error report

Hi, everybody.

When I run a SS-NEB calculation, the following information is reported.

CPUs are still running but no further new results are exported.

N E dE d eps ncg rms rms(c)
ERROR FEXCP: supplied Exchange-correletion table
is too small, maximal index : 4344
DAV: 1 0.351912153098E+04 0 ...