[DFTB-Plus-User] request information

[Amar Ansi]

Dear

Why did not geometry converge?
<https://www.researchgate.net/post/why_did_not_geometry_converge>
I am using DFTB+ for the optimization of the protein (146 atoms). so I got
SCC converged, but Geometry did NOT converge.
could you help me to solve this problem?




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11/20/19,
05:27:37 PM
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