[CP2K-user] [CP2K:20762] Segmentation Fault (SIGSEGV) when Using RESP in Geometry Optimization

[Souvik Mondal]

Hello CP2K community,

I am encountering a *segmentation fault (SIGSEGV)* while performing a 
geometry optimization on a protein system with a catalytic Zn site using 
CP2K. The geometry optimization runs successfully without the *RESP* 
section, but when I include the RESP section, I receive the following error 
after the first geometry optimization step:


Program received signal SIGSEGV: Segmentation fault - invalid memory 
reference.

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