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Nitroaromatics photophysics and photochemistry: a quantum dynamics study


Insights into the Complex Photophysics and Photochemistry of the Simplest Nitroaromatic Compound: A CASPT2//CASSCF Study on Nitrobenzene

Author(s): Angelo Giussani, Graham A. Worth
Published in: Journal of Chemical Theory and Computation, Issue 13/6, 2017, Page(s) 2777-2788, ISSN 1549-9618
Publisher: American Chemical Society
DOI: 10.1021/acs.jctc.6b01149

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