Nonadiabatic Nuclear Dynamics in the Ammonia Cation Studied by the Branching Classical Trajectory Method

被引：0
|
作者：
Belyaev, A. K. [1 ,2 ]
Lebedev, O. V. [1 ]
Domcke, W. [3 ]
机构：
[1] Herzen Univ, Dept Theoret Phys, St Petersburg 191186, Russia
[2] Uppsala Univ, Dept Phys & Astron, S-75120 Uppsala, Sweden
[3] Tech Univ Munich, Dept Chem, D-85747 Garching, Germany
来源：
XXVII INTERNATIONAL CONFERENCE ON PHOTONIC, ELECTRONIC AND ATOMIC COLLISIONS (ICPEAC 2011), PTS 1-15 | 2012年 / 388卷
基金：
俄罗斯基础研究基金会;
关键词：
PHOTOIONIZATION-INDUCED DYNAMICS; WAVE-PACKET CALCULATIONS;
D O I：
10.1088/1742-6596/388/10/102005
中图分类号：
O64 [物理化学（理论化学）、化学物理学]; O56 [分子物理学、原子物理学];
学科分类号：
070203 ; 070304 ; 081704 ; 1406 ;
摘要：
The photoinduced nonadiabatic nuclear dynamics of the ammonia cation is studied by the branching classical trajectory approach. The time-dependent populations of different electronic states of the ammonia cation are calculated and are in good agreement with the results of full quantum calculations.
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页数：1
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