TSim Module

A module for the MATLAB®-based trEPR toolbox for simulating spectra of spin-polarised triplet states.

	Documentation	https://tsim.docs.till-biskup.de/
	Download	https://github.com/tillbiskup/matlab-trepr-tsim
	License	GNU LGPL v3
	Programming language	MATLAB®
	Status	production/stable
	DOI	10.5281/zenodo.7395749

The module provides a user-friendly interface for simulations as well as fittings of simulations to experimental data. For the actual simulation it relies on EasySpin and in particular the pepper routine.

If using this program leads to a publication, please cite the following reference:

Deborah L. Meyer, Florian Lombeck, Sven Huettner, Michael Sommer, Till Biskup
Direct S₀→T Excitation of a Conjugated Polymer Repeat Unit: Unusual Spin-Forbidden Transitions Probed by Time-Resolved Electron Paramagnetic Resonance Spectroscopy
J. Phys. Chem. Lett., 8:1677–1682, 2017.

Features

A rather incomplete list…

Comfortable CLI for fit and simulation
Modular Design
All routines operate on datasets
Loading different file formats
Integrated help
Reports
Complete simulation and fit history
Many Bugs (mostly undiscovered yet)

System Requirements

Matlab 2012a (7.14) or newer (only tested with 2012a and newer)
trEPR-Toolbox
EasySpin-Toolbox