On the short and long phosphorescence lifetimes of aromatic carbonyls
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<em>The datasets generated during the study of phosphorescence lifetimes of aromatic carbonyl compounds. </em> <br> <em>The molecules studied are:</em> <br> benzaldehyde (BA),<em> </em> 4-methylbenzaldehyde (MeBA), 4-methoxybenzaldehyde (MoBA), 4-dimethylaminobenzaldehyde (DMABA). <br> <em>The repository contains the Cartesian coordinate of stationary structures and the raw data of the NEA simulations of emission spectra. </em> <br> <em>The NEA phosphorescence method was implemented in Newton-X and is publicly available (</em>www.newtonx.org<em>).</em>
创建时间:
2023-06-14



