Search found 186 matches
- Wed May 11, 2016 12:44 am
- Forum: General forum
- Topic: Chemical exchange- how to?
- Replies: 7
- Views: 3453
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?
- Wed Dec 23, 2015 1:01 am
- Forum: General forum
- Topic: Vanadium 51 Trouble: PLEASE HELP!!
- Replies: 4
- Views: 2899
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);
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);
- Tue Dec 22, 2015 11:54 pm
- Forum: Bugs
- Topic: How does FitOpt.Plot option works?
- Replies: 4
- Views: 4131
Re: How does FitOpt.Plot option works?
I think, it should be better to keep such feature for clarity.
- Tue Dec 22, 2015 11:48 pm
- Forum: Bugs
- Topic: Dimensions of return values from eprload and esfit
- Replies: 2
- Views: 3319
Re: Dimensions of return values from eprload and esfit
Thanks. I used reshape function to override this inconvenience.
- Tue Dec 22, 2015 1:46 am
- Forum: Bugs
- Topic: How does FitOpt.Plot option works?
- Replies: 4
- Views: 4131
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?
....
FitOpt.Plot=1;
[bestfit,bestspc] = esfit('garlic',y,Sys,Vary,Exp,[],FitOpt);
....
But there are no graphics appear. What I'm doing wrong?
- Tue Dec 22, 2015 1:08 am
- Forum: Bugs
- Topic: Dimensions of return values from eprload and esfit
- Replies: 2
- Views: 3319
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.