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Post by Shunyi » Tue Jun 04, 2024 4:53 am
Dear EasySpin Community,
I am trying to do a simulation of EPR with one copper and three nitrogen (maybe more). The problem now is that I can not run the esfit. I'd like to ask what kind of computer settings I need, to run the esfit with four cores (or more than 4).
Post by Stefan Stoll » Tue Jun 04, 2024 1:06 pm
Simulations with many nuclei (Cu and several N in your case) result in large matrices. Therefore, you need a lot of memory.
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