2-component analysis system!!

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gabrielthomass
Newbie
Posts: 3
Joined: Mon Apr 29, 2019 1:39 am

2-component analysis system!!

Post by gabrielthomass »

Hello to all !

I am working in 2-component EPR simulations using the chili, but I was wonderng if there is any possible way to calculate from the simulated spectra the percentage of each population. As I am a new user of Easyspin for multicomponent systems any suggestion will be usefull for me.

Thank you in advance.

Best regards
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Stefan Stoll
EasySpin Creator
Posts: 1100
Joined: Mon Jul 21, 2014 10:11 pm
Location: University of Washington

Re: 2-component analysis system!!

Post by Stefan Stoll »

It is not clear what you are asking for. Are you simulating multi-component spectra, or are you fitting experimental multi-component spectra. In the latter case, if you want to fit the weights, you can use esfit and include Sys.weight among the parameters to fit. Sys.weight holds the weight per component.
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