[CP2K-user] [CP2K:16502] out of memory- QM/MM

[ışılay öztürk]

Dear all,

I defined to memory but many times It has given to the problem as an out of
memory and mu calculation has not been able to complete.
I tried to so many things but I haven't any idea what is wrong. I got this
error with PBE, WB97X-D and BLYP.
It was only completed with PM3.

I am trying to apply QM/MM

Do you have any idea what I need to do about "out of memory"?

Best regards

Işılay

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