首页> 外文期刊>The Journal of Chemical Physics >The near-IR spectrum of NO((X)over-tilde(2)Pi)-He detected through excitation into the (A)over-tilde-state continuum: A joint experimental and theoretical study
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The near-IR spectrum of NO((X)over-tilde(2)Pi)-He detected through excitation into the (A)over-tilde-state continuum: A joint experimental and theoretical study

机译:通过激发进入(A)倾斜状态连续体来检测NO((X)倾斜(2)Pi)-He的近红外光谱:联合实验和理论研究

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We present the first measurement of a bound-state spectrum of the NO-He complex. The recorded spectrum is associated with the first overtone transition of the NO moiety. The IR absorption is detected by exciting the vibrationally excited complex to the (A) over tilde -state dissociation continuum. The resulting NO(A) fragment is subsequently ionized in the same laser pulse. We recorded two bands centered around the NO monomer rotational lines, Q(11)(0.5) and R-11(0.5), consistent with an almost free rotation of the NO fragment within the complex. The origin of the spectrum is found at 3724.06 cm(-1) blue shifted by 0.21 cm(-1) from the corresponding NO monomer origin. The rotational structures of the spectrum are found to be in very good agreement with calculated spectra based on bound states derived from a set of high level ab initio potential energy surfaces [Klos et al. J. Chem. Phys. 112, 2195 (2000)]. Published by AIP Publishing.
机译:我们介绍了NO-He配合物的束缚态光谱的首次测量。记录的光谱与NO部分的第一个泛音跃迁有关。通过在波浪状态解离连续体上将振动激发的络合物激发到(A)来检测IR吸收。随后在相同的激光脉冲中将生成的NO(A)片段电离。我们记录了围绕NO单体旋转线Q(11)(0.5)和R-11(0.5)的两个谱带,与复合物中NO片段的几乎自由旋转一致。光谱的原点位于3724.06 cm(-1)蓝色,与相应的NO单体原点相比偏移了0.21 cm(-1)。发现光谱的旋转结构与基于从一组高级从头算起的势能面得到的结合态的计算光谱非常吻合[Klos等。 J.化学物理112,2195(2000)]。由AIP Publishing发布。

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