首页> 外文期刊>The Journal of Chemical Physics >COMPUTATIONAL STUDY OF MANY-DIMENSIONAL QUANTUM VIBRATIONAL ENERGY REDISTRIBUTION .1. STATISTICS OF THE SURVIVAL PROBABILITY
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COMPUTATIONAL STUDY OF MANY-DIMENSIONAL QUANTUM VIBRATIONAL ENERGY REDISTRIBUTION .1. STATISTICS OF THE SURVIVAL PROBABILITY

机译:多维量子振动能量再分配的计算研究.1。生存概率统计

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We statistically analyze the dynamics of vibrational energy flow in a model system of anharmonic oscillators which are nonlinearly coupled, with a local topology. The spectra of many basis states of similar energy are computed, for different values of the magnitude of the coupling in the Hamiltonian between these states. From individual spectra of zero order basis states at each coupling strength the individual survival probabilities are determined, which are then used in computing statistical averages. When the average fluctuation of the survival probability is small, in the strongly coupled limit, the average survival probability closely follows a semiclassical diffusion prediction and reflects a predicted linear dependence of the rate of energy flow on coupling strength. When the average fluctuation is large, in the weakly coupled limit, the average survival probability closely follows a power law decay of t(-1), in agreement with a quantum extension of the diffusion picture. In this regime, individual survival probabilities show strong quantum beats. We conclude that these large variations reflect a strong influence of quantum interference in the weakly coupled limit. (C) 1996 American Institute of Physics. [References: 30]
机译:我们统计分析了非谐振荡器模型系统中振动能量流的动力学,该模型系统与局部拓扑非线性耦合。对于这些状态之间的哈密顿量的耦合大小的不同值,计算了具有相似能量的许多基本状态的光谱。根据各个耦合强度下零阶基态的各个光谱,确定各个生存概率,然后将其用于计算统计平均值。当生存概率的平均波动较小时,在强耦合极限内,平均生存概率紧密遵循半经典扩散预测,并反映了能量流率对耦合强度的线性预测依赖性。当平均波动大时,在弱耦合极限中,与扩散图的量子扩展一致,平均生存概率紧随幂律衰减t(-1)。在这种情况下,个体的生存概率表现出很强的量子跳动。我们得出的结论是,这些大变化反映了弱耦合极限中量子干扰的强大影响。 (C)1996年美国物理研究所。 [参考:30]

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