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Published in 2020 at "Chemical Physics"
DOI: 10.1016/j.chemphys.2020.110907
Abstract: Abstract In this work, a feasible method has been introduced for investigating the proton tunneling frequency in Naphthazarin (NZ). A two-dimensional potential energy surface which couples OH stretching with in-plane bending modes has been computed…
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Keywords:
frequency;
hydrogen bond;
intramolecular hydrogen;
nature intramolecular ... See more keywords
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Published in 2023 at "ACS Omega"
DOI: 10.1021/acsomega.2c07300
Abstract: We have studied the nonlinear absorptive and dispersive responses considering a molecular system consisting of two-levels, where aspects of the vibrational internal structure and intramolecular coupling are inserted, in addition to the considerations of interaction…
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Keywords:
stochastic nature;
intramolecular coupling;
nature intramolecular;
optical response ... See more keywords