Wavepacket insights into the photoprotection mechanism of the UV filter methyl anthranilate

<p>Geometries of the S_0,eq(S0_geom.csv), S_1,eq (S1_geom.csv), and D⁺_0,eq (D0+_geom.csv) states of MA contain atom labels (<em>e.g.</em> C) and Cartesian coordinates in four columns; distances are in Angstroms (&Aring;).</p> <p>All TR-PES transients are formatted as comma separated variable text files: each column is the photoelectron intensity&nbsp;at one time delay (labeled in the first row) with one eKE value per row (labeled in the first column). Files are labeled with the molecule, pump wavelength, probe wavelength, and a date (<em>e.g</em>. MA_344_285_18June2018.csv).</p> <p>The MATLAB code used to calculate the wavepacket &ldquo;transients&rdquo; is also contained herein as wavepacket.m. The code takes user inputs such as the Franck-Condon factors and laser pulse spectral characteristics.</p> <p>The LIF spectrum of photoexcited MA (MA_LIF.csv) is also presented as two columns: pump photon energy and LIF intensity.</p>