[CP2K-user] [CP2K:20595] Extreamly slow initial SCF Convergence in QMMM Calculations

권경표 kkp2514 at gmail.com
Thu Aug 22 05:47:29 UTC 2024


Hello,

I am currently running QMMM calculations with EGFP, but I'm facing a 
problem where the initial SCF convergence is taking an extremely long time. 
I've attached my input (inp) and log files for reference.

Could you please help me identify what might be causing this issue?

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