Please post a mininal and self-contained example script that shows how you envision this to work.
Search found 1028 matches
- Tue May 07, 2024 3:01 pm
- Forum: Bugs
- Topic: Automatic definition of Exp.nPoints for esfit() function
- Replies: 11
- Views: 8867
- Tue May 07, 2024 2:47 pm
- Forum: General forum
- Topic: Modelling VT-EPR of an antiferromagnetically-coupled system
- Replies: 1
- Views: 16
Re: Modelling VT-EPR of an antiferromagnetically-coupled system
I suggest reaching out to the authors (particularly the corresponding author) of this paper. They will be best placed to answer your questions.
- Tue May 07, 2024 2:40 pm
- Forum: General forum
- Topic: Easyspin compile required for esfit version 6.0.0
- Replies: 7
- Views: 284
Re: Easyspin compile required for esfit version 6.0.0
Thanks for reporting back. Your initial issue, where MATLAB could not locate some of the files from the private
subfolder, is still puzzling. It seems to be unrelated to the compilation issues.
- Tue May 07, 2024 2:39 pm
- Forum: General forum
- Topic: erpload from Magnettech
- Replies: 3
- Views: 265
Re: erpload from Magnettech
Understood, thanks.
The format specification for the SPE files that we have does not list a Timestamp or KineticSamplingTime parameter. We'll see if we can obtain a more up-to-date specification. Meanwhile, can you share the XML file corresponding to the SPE file you shared?
- Thu May 02, 2024 11:04 pm
- Forum: General forum
- Topic: erpload from Magnettech
- Replies: 3
- Views: 265
Re: erpload from Magnettech
Currently, EasySpin only reads 1D .spe files.
Can you please share a two-dimensional .spe file so we can look into this?
- Thu May 02, 2024 11:00 pm
- Forum: General forum
- Topic: Issues with Levenberg/Marquart, garlic in Version 6.0.0
- Replies: 1
- Views: 104
Re: Issues with Levenberg/Marquart, garlic in Version 6.0.0
Thanks for reporting the error in the fitting userguide!
Regarding the issue with garlic
and esfit
, please post your spin system variable DMPO_SYS
and DMPO_VARY
.
- Thu May 02, 2024 10:47 pm
- Forum: General forum
- Topic: eeFrame and Sys.J/Sys.dip
- Replies: 1
- Views: 42
Re: eeFrame and Sys.J/Sys.dip
Use Sys.eeFrame
. Demonstration:
Code: Select all
clear, clc
Sys.S = [1/2 1/2];
Sys.dip = 10;
Sys.eeFrame = [0 0 0];
ham_ee(Sys)
Sys.eeFrame = [0 pi/4 0];
ham_ee(Sys)
- Mon Apr 22, 2024 8:54 am
- Forum: Bugs
- Topic: Automatic definition of Exp.nPoints for esfit() function
- Replies: 11
- Views: 8867
Re: Automatic definition of Exp.nPoints for esfit() function
Please post a specific example that has the behavior you are suggesting, so we can consider it.
- Mon Apr 22, 2024 8:53 am
- Forum: General forum
- Topic: Easyspin compile required for esfit version 6.0.0
- Replies: 7
- Views: 284
Re: Easyspin compile required for esfit version 6.0.0
There seem to be two unrelated issues here:
MATLAB can't find (some) p-files in the
private
folder. Unclear what is going on here.The C/C++ compilation environment was not set up on your machine. Have you run
mex -setup
? See here.
- Mon Apr 22, 2024 8:46 am
- Forum: General forum
- Topic: Intensity from resfreqs output vs explicit calculation
- Replies: 3
- Views: 258
Re: Intensity from resfreqs output vs explicit calculation
It makes sure that the total spectra intensity is independent of nuclear spins. For example, 15N and 14N give 2 and 3 lines respectively, to give the same overall intensity, the 15N line intensities are divided by 2, and the 14N by 3.