研究太赫兹双原子分子光谱的模拟计算机

Usman Malik, Muhamad Hamdi, S. Salomo
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引用次数: 0

摘要

本文介绍了具有一定控制参数的刚性双原子转子模型的滚振太赫兹谱的谐振子模型。该模型显示了双原子分子振动跃迁的旋转分辨太赫兹波段光谱的研究。太赫兹辐射吸收被用作封闭系统,称为模拟计算机动力学模式。双原子分子的光学太赫兹区光谱由一系列谱线组成。他们的分离并不是一成不变的。双原子分子并不是真正的刚性旋转体,因为它同时以很小的振幅振动。由于量子化的振动和旋转能级以及选择规则,允许的跃迁导致由中心间隙分隔的P分支组成的高度有序的频谱。相邻谱线间距为2B,由于谱线强度取决于热居的玻尔兹曼因子和量子数J,因此每个分支单调地增加和减少。随着温度的升高,观察到更多的线,并且由于种群分布在更多的旋转水平上,线强度降低。交互作用研究还涉及到基本振动频率、旋转常数B和含温谱线宽度对观测光谱的影响。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
ANALOG COMPUTER FOR STUDYING DIATOMIC MOLECULAR SPECTRA IN TERAHERTZ FREQUENCY
This paper introduces a harmonic oscillator model for rovibronic terahertz spectrum of a model of a rigid diatomic rotor with some control parameters. The model shows a study of rotationally-resolved terahertz band spectra of the vibrational transition in diatomic molecules. THz radiation absorption is used as a closed-form system known as the analog computer dynamics mode. The optical terahertz region spectrum of the diatomic molecule consists of a series of lines. Their separations are not exactly constant. A diatomic molecule is not truly a rigid rotator, because it simultaneously vibrates with a small amplitude. Due to quantized vibrational and rotational energy levels and the selection rules, allowed transitions result in a highly ordered spectrum consisting of a P branch separated by a central gap. Adjacent spectral lines are separated by a spacing of 2B, and since line intensities depend on Boltzmann factor for thermal population and quantum number J, each branch monotonically increases and decreases. As temperature increases, more lines are observed, and line intensities decrease due to the population being spread over more rotational levels. Interactivity research also involves on effects of the fundamental vibrational frequency, rotational constant B and temperature included line width on the observed spectrum.
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