[CP2K-user] What is the correlation between computer's memory and the number of atoms

[张炎炎]

Hi All

I use cp2k to simulate 80000 atoms, but it reports error: cannot allocate 
memory. Maybe my computer's memory (24*16GB) isn't enough.
So I want to know the correlation between computer's memory and the number 
of atoms. 


Thanks in advance and regards

Yanyan
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