Article ID Journal Published Year Pages File Type
6877792 Journal of Molecular Graphics and Modelling 2013 7 Pages PDF
Abstract
The first hyperpolarizability values of the v shaped complexes are larger than that of the linear shape complex, which indicates that larger intramolecular charge transfer for the v shaped complexes might occur under the external electric field. And the changes in first hyperpolarizability values can be explained by the combined effect of the difference between the ground state and excited state dipole moment, the oscillator strength, and the cube of the transition energy.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
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