用非线性量子理论计算ch3cn分子的高激发振动能级

Acta Physica Sinica (overseas Edition) Pub Date : 1999-06-01 DOI:10.1088/1004-423X/8/6/005

Zhu Jun, Gou Qing-Quan

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引用次数: 1

摘要

采用三参数非线性动力学模型，即量子化离散自俘获方程，计算了液相CH3CN分子在电子基态高达n=7时的高激发CH拉伸振动能级。计算结果表明，该模型可以很好地描述实验能级。

本文章由计算机程序翻译，如有差异，请以英文原文为准。

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CALCULATION OF HIGHLY EXCITED VIBRATIONAL ENERGY LEVELS OF CH 3 CN MOLECULE BY NON-LINEAR QUANTUM THEORY

A three-parameter nonlinear dynamical model, i.e., the quantized discrete self-trapping equation, was used to calculate the highly excited CH stretching vibrational energy levels of liquid phase CH3CN molecule in the electronic ground state up to n=7. The calculated results show that the experimental energy levels can be well described by the model.

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Acta Physica Sinica (overseas Edition)

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