Search found 186 matches

by katarkon
Wed May 11, 2016 12:44 am
Forum: General forum
Topic: Chemical exchange- how to?
Replies: 7
Views: 3440

Chemical exchange- how to?

It seems that EasySpin can simulate cw spectra with chemical exchange broadening (J. Phys. Chem. A, 2013, 117 (7), pp 1439–1448 DOI: 10.1021/jp3104358). Unfortunately, there are no any documentation about this feature. Is it possible to provide some examples for this topic?
by katarkon
Wed Dec 23, 2015 1:01 am
Forum: General forum
Topic: Vanadium 51 Trouble: PLEASE HELP!!
Replies: 4
Views: 2888

Re: Vanadium 51 Trouble: PLEASE HELP!!

Try this script:

Sys.S = 1/2;
Sys.g = [1.9875 1.9835 1.9510];
Sys.lwpp = .5;
Sys.Nucs = '51V';
Sys.A = [175 180 505];
Exp.Harmonic = 1
Exp.mwFreg = 9.78;
Exp.Range = [260 440];
Exp.nPoints = 2048;
pepper(Sys,Exp);
by katarkon
Tue Dec 22, 2015 11:54 pm
Forum: Bugs
Topic: How does FitOpt.Plot option works?
Replies: 4
Views: 4100

Re: How does FitOpt.Plot option works?

I think, it should be better to keep such feature for clarity.
by katarkon
Tue Dec 22, 2015 11:48 pm
Forum: Bugs
Topic: Dimensions of return values from eprload and esfit
Replies: 2
Views: 3295

Re: Dimensions of return values from eprload and esfit

Thanks. I used reshape function to override this inconvenience.
by katarkon
Tue Dec 22, 2015 1:46 am
Forum: Bugs
Topic: How does FitOpt.Plot option works?
Replies: 4
Views: 4100

How does FitOpt.Plot option works?

I try to run esfit function with FitOpt.Plot=1 in this manner:
....
FitOpt.Plot=1;
[bestfit,bestspc] = esfit('garlic',y,Sys,Vary,Exp,[],FitOpt);
....

But there are no graphics appear. What I'm doing wrong?
by katarkon
Tue Dec 22, 2015 1:08 am
Forum: Bugs
Topic: Dimensions of return values from eprload and esfit
Replies: 2
Views: 3295

Dimensions of return values from eprload and esfit

The function eprload returns x and y values in different dimensions. The x values return as <1 x nPoints double> whereas y ones return as <nPoints x 1 double>. Moreover, esfit returns y values as <1 x nPoints double>, it makes certain inconvenience.