[Pw_forum] NEB error: unexpected dimension in ngg

Egbert Barnard BarnardEP at ufs.ac.za
Sat May 28 10:35:35 CEST 2011


I am performing a NEB calculation on a Fe-S system and after the calculation has run for a few hours I get the following error.

     task #        22
     from igk_l2g_kdip : error #         1
     unexpected dimension in ngg

Any help solving this problem would be greatly appreciated 

Pieter Barnard
University of the Free State
South Africa



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