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Vibrational energy transfer in N(2D)+N2 collisions: a quasiclassical trajectory study

机译:N(2D)+ N2碰撞中的振动能量传递:准经典轨迹研究

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摘要

Rate coefficients for the N(2D)+N2 collisions were calculated employing quasiclassical trajectories and the first available set of potential energy surfaces for such excited nitrogen interactions. The details of the vibrational energy transfer are discussed, such as the contributions from reactive and non-reactive trajectories as well as the contribution of each electronic symmetry. The calculated state-to-state and state-to-all rate coefficients show that deactivation is far more probable than excitation, and multi-quanta deactivation play an important role.
机译:N(2D)+ N2碰撞的速率系数是使用准经典轨迹和此类激发氮相互作用的第一组可用势能面计算的。讨论了振动能量传递的细节,例如无功和无功轨迹的贡献以及每个电子对称性的贡献。计算出的状态间和状态间所有速率系数表明,失活比激发更有可能发生,并且多量子失活起着重要的作用。

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