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Dear EasySpin team, I would like to simulate a orientation selective transient nutation experiment on high-spin systems. My code is below based on evolve(). It runs, but I don't observe a nutation frequency. It looks just noisy. I have tried to change the knots and tried different magnetic fields. I...

Ok.
Thank you.

Hi,
Opt.PostConvNucs works by removing the linewidth. But I receive the same error massage by applying Sys.lambda.:
Error using chili (line 451)
Ordering potential not supported for Opt.LiouvMethod='general'.

sorry but both ways don't work. Maybe I've done something wrong: 1. Simulate with full SLE: %Define Spin-System Sys.S=1/2; Sys.g=2.0023; Sys.Nucs='1H,1H,1H'; Sys.lwpp=[0.2 0.2]; Sys.A=[-98 -62 -21;-97 -61 -20;102 102 102]; Sys.AFrame=[2 30 102;-15 30 -62;0 0 0]*pi/180; Sys.logtcorr=-9; Sys.lambda=2;...

Thanks for your answer. I have explained something wrong. I have two rhombic HFS tensors rotating around the same dihedral angle. But there is thrid nucleus (quit isotropic HFS) which is not rotating. When I run chili with all three nuclei, it does not work. Is there a way to simulate this system wi...

Hi, I want to simulate a EPR spectra with chili. I expect two nuclei with highly rhombic HFS tensors. But they can do a hindered rotation due to a rotational barrier. Is it possible to manage this problem with chili? I think there is currently a hindered rotation implemented only for one nucleus wit...

Thanks

Thanks you very much.

Last question:
Is the last value in Exp.t the delay from the last pulse to the echo?

Simulating solid-state cw EPR spectra.....

The higher nKnots, the finer the orientational grid. The default value of 19 (5-degree increments) is appropriate for most systems. A value larger than 181 (0.5-degree increments) is rarely needed.

Dear easyspin team, 1. By using a user defined pulse sequence in saffron, what is the definition of the inital pulse deplays (Exp.t)? Are these the values from the beginning of one pulse to the beginning of the next pulse, or from the end of one pulse to the beginning of the next pulse? 2. Is the Op...