[Pw_forum] Neb calclution -Error in routine engine_to_path_pos (2): inconsistency of atomic species

Elham e.chemistry83 at gmail.com
Sun Dec 20 17:35:53 CET 2015


Dera Pr. Paolo

Thanks so much. yes problem about this mismatch of  initial and product
coordinates .
sorry about easy question.

best Regards
Elham
IASBS
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