首页> 外文期刊>The Journal of Chemical Physics >Electron collisions with methyl-substituted ethylenes: Cross section measurements and calculations for 2-methyl-2-butene and 2,3-dimethyl-2-butene
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Electron collisions with methyl-substituted ethylenes: Cross section measurements and calculations for 2-methyl-2-butene and 2,3-dimethyl-2-butene

机译:与甲基取代的乙烯的电子碰撞:2-甲基-2-丁烯和2,3-二甲基-2-丁烯的截面测量和计算

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We report electron-scattering cross sections determined for 2-methyl-2-butene [(H3C)HC=C(CH3)(2)] and 2,3-dimethyl-2-butene [(H3C)(2)C=C(CH3)(2)] molecules. Absolute grand-total cross sections (TCSs) were measured for incident electron energies in the 0.5-300 eV range, using a linear electron-transmission technique. The experimental TCS energy dependences for the both targets appear to be very similar with respect to the shape. In each TCS curve, three features are discernible: the resonant-like structure located around 2.6-2.7 eV, the broad distinct enhancement peaking near 8.5 eV, and a weak hump in the vicinity of 24 eV. Theoretical integral elastic (ECS) and ionization (ICS) cross sections were computed up to 3 keV by means of the additivity rule (AR) approximation and the binary-encounter-Bethe method, respectively. Their sums, (ECS+ICS), are in a reasonable agreement with the respective measured TCSs. To examine the effect of methylation of hydrogen sides in the ethylene [H2C=CH2] molecule on the TCS, we compared the TCS energy curves for the sequence of methylated ethylenes: propene [H2C=CH(CH3)], 2-methylpropene [H2C=C(CH3)(2)], 2-methyl-2-butene [(H3C) HC=C(CH3)(2)], and 2,3-dimethyl-2-butene [(H3C)(2)C=C(CH3)(2)], measured in the same laboratory. Moreover, the isomeric effect is also discussed for the C5H10 and C6H12 compounds. (C) 2015 AIP Publishing LLC.
机译:我们报告了2-甲基-2-丁烯[(H3C)HC = C(CH3)(2)]和2,3-二甲基-2-丁烯[(H3C)(2)C = C确定的电子散射截面(CH3)(2)]分子。使用线性电子传输技术,测量了入射电子能量在0.5-300 eV范围内的绝对总横截面(TCS)。两个目标的实验TCS能量依赖性在形状方面都非常相似。在每条TCS曲线中,可以看出三个特征:类似共振的结构位于2.6-2.7 eV附近,在8.5 eV附近出现明显的增强峰,并且在24 eV附近出现了弱驼峰。理论上的积分弹性(ECS)和电离(ICS)截面分别通过加性法则(AR)逼近法和Binary-encounter-Bethe方法计算出了3 keV。它们的总和(ECS + ICS)与各自测得的TCS合理一致。为了检查乙烯[H2C = CH2]分子中氢侧的甲基化对TCS的影响,我们比较了甲基化乙烯序列的TCS能量曲线:丙烯[H2C = CH(CH3)],2-甲基丙烯[H2C = C(CH3)(2)],2-甲基-2-丁烯[(H3C)HC = C(CH3)(2)]和2,3-二甲基-2-丁烯[(H3C)(2)C = C(CH3)(2)],在同一实验室中测量。此外,还讨论了C5H10和C6H12化合物的异构作用。 (C)2015 AIP Publishing LLC。

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