An accurate prediction of adiabatic excitation energies to the low-lying electronic states for acetophenone and the related carbonyl compounds
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Biochemistry
Reference27 articles.
1. Theoretical Analysis of the Electronic Spectra of Benzaldehyde
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3. Active out-of-plane modes in of benzaldehyde vapor
4. Sensitized phosphorescence excitation spectra of biacetyl, benzaldehyde and benzophenone in supersonic jets
5. Why does intersystem crossing occur in isolated molecules of benzaldehyde, acetophenone, and benzophenone?
Cited by 17 articles. 订阅此论文施引文献 订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献
1. "The full mapping of low-lying excited state relaxation dynamic pathways for acetophenone ";Studia Universitatis Babeș-Bolyai Chemia;2021-09-30
2. Direct Observation of the Solvent Effects on the Low-Lying nπ* and ππ* Excited Triplet States of Acetophenone Derivatives in Thermal Equilibrium;The Journal of Physical Chemistry B;2015-02-24
3. Triplet state photochemistry and the three-state crossing of acetophenone within time-dependent density-functional theory;The Journal of Chemical Physics;2014-04-07
4. Electronic Relaxation in Benzaldehyde Evaluated via TD-DFT and Localized Diabatization: Intersystem Crossings, Conical Intersections, and Phosphorescence;The Journal of Physical Chemistry C;2013-09-19
5. Theoretical study of the photochemical generation of triplet acetophenone;Physical Chemistry Chemical Physics;2013
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