[CP2K-user] dmax for geo opt
jclaver... at gmail.com
Wed Jan 9 15:41:24 UTC 2019
Does anyone know how can we set the maximum distance for atomic
displacement during GEO_OPT?
I am looking for the equivalent of this command:
Jérôme Claverie, PhD candidate
Department of Physics and Chemistry, UNESP, Ilha Solteira-SP, Brazil
Laboratory of Civil Engineering and Mechanical Engineering, INSA de Rennes, France
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