Search found 3 matches

by gabrielthomass
Tue Apr 30, 2019 6:11 am
Forum: General forum
Topic: 2-component analysis system!!
Replies: 1
Views: 1534

2-component analysis system!!

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. Than...
by gabrielthomass
Tue Apr 30, 2019 6:11 am
Forum: General forum
Topic: ELDOR-detected NMR VS symmetry!!
Replies: 1
Views: 1396

ELDOR-detected NMR VS symmetry!!

Dear someone, Recently I have been working on the simulation of EDNMR for an spin half and half powder system using the code provided by Anton.Savitsky. It turns out if I specified different symmetry in the simulation, the NMR intensity will be different. I checked the code, which use sphgrid functi...
by gabrielthomass
Mon Apr 29, 2019 1:41 am
Forum: General forum
Topic: 17O Davies ENDOR Mn2+ high spin!!!
Replies: 1
Views: 1160

17O Davies ENDOR Mn2+ high spin!!!

Hi there, I've tried to simulate a 17O Mn2+ davies ENDOR spectrum and output each transition seperatly. Opt.Output = 'separate' doesn't work here. Maybe anyone got a diffent idea to return each transition seperatly. Thanks clear, clf expspec=load('mn.txt'); % freq0=expspec(:,1); %mT Spec0 = expspec(...