I am a new one in learning Easyspin software.
Now, I am trying to simulate the EPR signal for diirradium complex from the result of DFT calculation.
can anyone please explain how to do that.
i am facing difficulties
With kind regards.
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- Sun Feb 09, 2025 7:23 am
- Forum: General forum
- Topic: EPR data from DFT calculation
- Replies: 1
- Views: 11913