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Studies on photodissociation of dibromoalkane in UV region

机译:紫外区二溴代烷的光解离研究

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摘要

The photodissociation of CH2Br2, 1,2-C2H4Br2 and 1,4-C4H8Br2 near 234 and 267 nm has been studied using resonance-enhanced multiphoton ionization with time-of-flight mass spectrometry. The wavelength dependence of the relative quantum yields Phi(Br), and Phi(Br*) for both Br(P-2(3/2)0) and Br*(P-2(1/2)0) channels was measured. The results indicated that the yields Phi(Br) of C2H4Br2 is larger than that of CH2Br2. And the quantum yields wavelength dependent of C4H8Br2 shows a different tendency compared to CH2Br2 and C2H4Br2. A likely explanation for the different quantum yields relies on the non-adiabatic transitions and avoided curve crossing mechanism. Additionally, ab initio calculations were performed to get potential energy surface curves of CH2Br2 to elucidate the photodissociation channels in UV region. (c) 2005 Elsevier B.V. All rights reserved.
机译:使用飞行时间质谱法研究了共振增强多光子电离技术,研究了CH2Br2、1,2-C2H4Br2和1,4-C4H8Br2在234和267 nm附近的光解离。测量了Br(P-2(3/2)0)和Br *(P-2(1/2)0)通道的相对量子产率Phi(Br)和Phi(Br *)的波长依赖性。结果表明,C2H4Br2的产率Phi(Br)大于CH2Br2。与CH2Br2和C2H4Br2相比,取决于C4H8Br2的波长的量子产率显示出不同的趋势。对于不同的量子产率的一种可能的解释取决于非绝热跃迁和避免的曲线交叉机制。此外,进行了从头算来获得CH2Br2的势能表面曲线,以阐明UV区的光解离通道。 (c)2005 Elsevier B.V.保留所有权利。

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