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TaO的傅里叶变换发射光谱学

Fourier Transform Emission Spectroscopy of TaO.

作者信息

Ram RS, Bernath PF

机构信息

Department of Chemistry, University of Arizona, Tucson, Arizona, 85721

出版信息

J Mol Spectrosc. 1998 Sep;191(1):125-36. doi: 10.1006/jmsp.1998.7620.

Abstract

The emission spectrum of TaO, excited in a tantalum hollow cathode lamp, has been observed at high resolution using a Fourier transform spectrometer. In addition to previously known transitions, a number of new bands have been identified and assigned as belonging to two new electronic transitions: H2Pi1/2-X2Delta3/2 and K2Phi5/2-X2Delta3/2. A rotational analysis ofthe 0-0 and 0-1 bands of the H2Pi1/2-X2Delta3/2 transition and of the 0-1, 1-2, 0-0, 1-0, and 2-1 bands of theK2Phi5/2-X2Delta3/2 transition has been carried out, providing the following equilibrium constants for the ground X2Delta3/2 state:omegae = 1028.9060(15) cm-1, omegaexe = 3.58928(66) cm-1, Be = 0.40289737(139) cm-1, alphae = 0.00185445(83) cm-1, andre = 1.6873430(29) Å. The principal molecular constants for the H2Pi1/2 state are T00 = 20 634.32758 (40) cm-1,B0 = 0.3766867(31) cm-1, and r0 = 1.7450604(72) Å, while the equilibrium constants for the K2Phi5/2 state areomegae = 905.4549(15) cm-1, omegaexe = 3.67601(64) cm-1, Be = 0.37965102(36) cm-1, alphae = 0.00189370(21) cm-1, andre = 1.7382343(8) Å. Although the H2Pi1/2 and K2Phi5/2 states have been observed previously in matrix isolation experiments, our work on these states is the first in the gas phase. Copyright 1998 Academic Press.

摘要

利用傅里叶变换光谱仪在高分辨率下观测了在钽空心阴极灯中激发的TaO发射光谱。除了先前已知的跃迁外,还识别出一些新谱带,并将其归属于两个新的电子跃迁:H²Π₁/₂ - X²Δ₃/₂和K²Φ₅/₂ - X²Δ₃/₂。对H²Π₁/₂ - X²Δ₃/₂跃迁的0 - 0和0 - 1谱带以及K²Φ₅/₂ - X²Δ₃/₂跃迁的0 - 1、1 - 2、0 - 0、1 - 0和2 - 1谱带进行了转动分析,得到了基态X²Δ₃/₂的下列平衡常数:ωₑ = 1028.9060(15) cm⁻¹,ωₑₓₑ = 3.58928(66) cm⁻¹,Bₑ = 0.40289737(139) cm⁻¹,αₑ = 0.00185445(83) cm⁻¹,rₑ = 1.6873430(29) Å。H²Π₁/₂态的主要分子常数为T₀₀ = 20634.32758 (40) cm⁻¹,B₀ = 0.3766867(31) cm⁻¹,r₀ = 1.7450604(72) Å,而K²Φ₅/₂态的平衡常数为ωₑ = 905.4549(15) cm⁻¹,ωₑₓₑ = 3.67601(64) cm⁻¹,Bₑ = 0.37965102(36) cm⁻¹,αₑ = 0.00189370(21) cm⁻¹,rₑ = 1.7382343(8) Å。尽管H²Π₁/₂和K²Φ₅/₂态先前已在基质隔离实验中观测到,但我们对这些态的研究是气相中的首次研究。版权所有1998年学术出版社。

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