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Published in 2021 at "Computational and Theoretical Chemistry"
DOI: 10.1016/j.comptc.2021.113244
Abstract: Abstract Here, we combined experimental measurements and DFT calculations to study UV-vis absorption spectra. DFT calculations of azobenzene and its derivatives proved useful for estimation of experimental spectra with near one-to-one correspondence. Calculation results show…
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Keywords:
vis absorption;
study vis;
dha dea;
absorption ... See more keywords