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四极离子阱中离子-中性粒子碰撞的真实建模。

Realistic modeling of ion-neutral collisions in quadrupole ion traps.

作者信息

He Muyi, Guo Dan, Feng Yan, Xiong Xingchuang, Zhang Huzhong, Fang Xiang, Xu Wei

机构信息

School of Life Science, Beijing Institute of Technology, Beijing, 100081, China.

出版信息

J Mass Spectrom. 2015 Jan;50(1):95-102. doi: 10.1002/jms.3501.

Abstract

In this study, three ion-neutral collision models have been discussed and compared, including the Langevin, the hard-sphere and the mixed collision models. With the pseudo-potential approximation, analytical expressions of ion secular motions with the hard-sphere and mixed collision models have been obtained for the first time. Through numerical simulations and theoretical calculations, it is found that the mixed collision model could be used as a general description of ion-neutral collisions under different conditions. Langevin collision model is a good description of low energy collisions between small ions and neutrals, while hard-sphere collision model could be used to describe high energy collisions and/or ions with higher masses (larger physical sizes). These analytical expressions of ion motion decay profiles enable the creation of direct relationships between time-domain image currents with ion collision cross sections.

摘要

在本研究中,讨论并比较了三种离子-中性粒子碰撞模型,包括朗之万模型、硬球模型和混合碰撞模型。利用赝势近似,首次得到了硬球碰撞模型和混合碰撞模型下离子长期运动的解析表达式。通过数值模拟和理论计算发现,混合碰撞模型可作为不同条件下离子-中性粒子碰撞的通用描述。朗之万碰撞模型很好地描述了小离子与中性粒子之间的低能碰撞,而硬球碰撞模型可用于描述高能碰撞和/或质量较大(物理尺寸较大)的离子。这些离子运动衰减曲线的解析表达式使得能够建立时域图像电流与离子碰撞截面之间的直接关系。

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