Hello,
I am planning on making a series of a compound with Mn2+ diluted in a diamagnetic matrix. Mn2+ is the only paramagnetic species in this system. I was wondering if there was a way to to simulate the cw X-band spectra of these compounds to see how the lines would be broadened by increasing Mn2+ concentration i.e. fully resolved hyperfine splitting at low Mn2+ concentrations vs single broad peak for high concentrations.
I tried changing the weight parameter and simulating with pepper, but I believe that only changes the intensity of the signal. Any advice is greatly appreciated.
Thank you!
Howie
Simulating concentration effects on broadening
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- EasySpin Creator
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Re: Simulating concentration effects on broadening
Unfortunately, it's currently not possible to simulate concentration effects.
Re: Simulating concentration effects on broadening
Is this not possible to implement at this point, Stefan?
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- EasySpin Creator
- Posts: 1059
- Joined: Mon Jul 21, 2014 10:11 pm
- Location: University of Washington
Re: Simulating concentration effects on broadening
It's currently not a priority, unfortunately.