Sum-frequency vibrational spectroscopy of limonene chiral liquids due to the nonadiabatic effect

Literature Information

Publication Date 2018-02-01
DOI 10.1039/C7CP08473K
Impact Factor 3.676
Authors

Ren-hui Zheng, Wen-mei Wei, Meng Xu, Qiang Shi


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Abstract

Using quantum computations we study sum-frequency vibrational spectroscopy of limonene chiral liquids due to the nonadiabatic effect in the non-resonant case for the first time. The nonadiabatic effect has an important impact on non-resonant antisymmetric polarizability and chiral sum-frequency vibrational spectroscopy. The theoretical spectroscopy agrees with the experimental spectroscopy. However, the nonadiabatic effect only has a small influence on non-resonant Raman. Bulk sum-frequency vibrational spectroscopy may become a powerful method of investigating the nonadiabatic effect and the nonradiative transition between excited electronic states for chiral molecules.

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Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics
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