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碰撞能量对反应Sr+ HF转动取向的影响(英文)

Rotational Alignment of the Reaction Sr+ HF as a Function of Collision Energies
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摘要 在推广 LEPS势能面上,用经典轨线方法,研究了反应碰撞能量对反应 Sr+ HF的转动取向的影响 .计算结果与产物轨道角动量模型进行比较 .计算结果表明,随着碰撞能量的增加,产物转动取向越强烈 . The trajectory calculations of the reaction Sr+ HF on the extended London- Eyring- Polanyi- Sato (LEPS) potential energy surface have been carried out to study the dependence of product rotational alignment on the collision energies. The calculated results for the reaction of Sr+ HF were compared with the predictions from the constrained product orbital angular momentum model. The final rotational angular momentum was found to be perpendicularly polarized with respect to the reagents′ relative velocity vector. The higher the collision energies are the more anisotropic is the distribution of the product rotational angular momentum vector.
出处 《物理化学学报》 SCIE CAS CSCD 北大核心 2001年第6期521-525,共5页 Acta Physico-Chimica Sinica
关键词 轨线计算 推LEPS势能面 碰撞能量 转动取向 氟化氢 反应机理 Trajectory calculation, LEPS potential energy surface, Collision energies, Rotational alignment
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二级参考文献5

  • 1Han K L,J Chem Phys,1996年,105卷,8699页
  • 2Zhang R,J Chem Phys,1988年,89卷,6283页
  • 3Qiu Caimeng,湘潭大学自然科学学报,2000年,21卷,4期,127页
  • 4Han K L,J Chem Phys,1996年,105卷,8699页
  • 5Zhang R,J Chem Phys,1988年,89卷,6283页

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