Toth RA
California Institute of Technology, Jet Propulsion Laboratory, Pasadena, California, 91109
J Mol Spectrosc. 1999 Mar;194(1):28-42. doi: 10.1006/jmsp.1998.7771.
High-resolution spectra of H216O were recorded with a Fourier-transform spectrometer covering transitions in the (020)-(010), (100)-(010), and (001)-(010) bands from 1100 to over 2300 cm-1. Also included in the study were previously reported measurements of these bands and measurements of the (020)-(000), (100)-(000), and (001)-(000) bands from 2620 cm-1 to 4500 cm-1. The linestrengths were fitted to a model which takes into account the interactions between the vibrational states (020), (100), and (001). The model included dipole moment matrix elements (also referred to as transition elements) represented by 19 expansion coefficients for B-type transitions and 14 expansion coefficients for A-type band transitions. The most satisfactory results were obtained when the relative signs and values of the leading dipole moment terms of each of the three "hot" bands were as follows: u(020-010) = 1.936(97) x 10(-1) D, u(100-010) = 3.876(19) x 10(-2) D, and u(001-010) = 2.523(75) x 10(-2) D. Hot water emission experimental frequencies from other studies were included in an analysis to obtain rotational energies for levels up to high J and/or Ka of the (020), (100), and (001) vibrational states. The results from this study provide a more accurate representation of the parameters than those available at present for the six bands. Copyright 1999 Academic Press.
使用傅里叶变换光谱仪记录了H₂¹⁶O的高分辨率光谱,覆盖了从1100至超过2300 cm⁻¹的(020)-(010)、(100)-(010)和(001)-(010)波段的跃迁。该研究还包括先前报道的这些波段的测量结果以及从2620 cm⁻¹至4500 cm⁻¹的(020)-(000)、(100)-(000)和(001)-(000)波段的测量结果。将谱线强度拟合到一个模型,该模型考虑了振动状态(020)、(100)和(001)之间的相互作用。该模型包括由19个B型跃迁展开系数和14个A型带跃迁展开系数表示的偶极矩矩阵元(也称为跃迁元)。当三个“热”波段中每个波段的主要偶极矩项的相对符号和值如下时,获得了最令人满意的结果:u(020 - 010) = 1.936(97)×10⁻¹ D,u(100 - 010) = 3.876(19)×10⁻² D,以及u(001 - 010) = 2.523(75)×10⁻² D。来自其他研究的热水发射实验频率被纳入分析,以获得(020)、(100)和(001)振动状态高达高J和/或Ka能级的转动能量。与目前可获得的六个波段的参数相比,本研究的结果提供了更准确的参数表示。版权所有1999年学术出版社。