CD_4分子伸缩振动能谱的非线性量子理论计算

CALCULATIONS OF STRETCHING VIBRATIONAL ENERGY SPECTRAOF CD4 MOLECULE BY NONLINEAR QUANTUM THEORY

利用非线性量子理论中的离散自陷方程，对ＣＤ４分子中ＣＤ键的伸缩振动谱（１≤ｎ≤６）进行了理论计算，所得结果与已知的实验谱值及其他作者的计算值符合较好．

The stretching vibrational energy spectra of CD bonds of CD4 molecule are calculated until total vibrational quantum number n=6 using the discrete selftrapping equation in nonlinear quantum theory.The result obtained are in good agreement with the known experimental spectral data and the values calculated by other authors.