Density functional theory study on anti-resonance in preresonance Raman scattering for naphthalene molecules.

@article{Zheng2007DensityFT,
  title={Density functional theory study on anti-resonance in preresonance Raman scattering for naphthalene molecules.},
  author={Ren-hui Zheng and Wen-mei Wei},
  journal={The journal of physical chemistry. A},
  year={2007},
  volume={111 18},
  pages={3652-60}
}
The anti-resonance phenomenon in preresonance Raman scattering is investigated on the basis of the direct Taylor expansion of the electric dipole transition moments in vibrational Raman tensors with respect to vibrational normal coordinates. A time-dependent density functional theory treatment is applied to compute the anti-resonance of a nontotally… CONTINUE READING