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Non-Hermitian approach for modeling of noise-assisted quantum electron transfer in photosynthetic complexes

机译:用于光合配合物中噪声辅助量子电子转移的非Hermitian方法

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摘要

We model the quantum electron transfer (ET) in the photosynthetic reaction center (RC), using a non- Hermitian Hamiltonian approach. Our model includes (i) two protein cofactors, donor and acceptor, with discrete energy levels and (ii) a third protein pigment (sink) which has a continuous energy spectrum. Interactions are introduced between the donor and acceptor, and between the acceptor and the sink, with noise acting between the donor and acceptor. The noise is considered classically (as an external random force), and it is described by an ensemble of two-level systems (random fluctuators). Each fluctuator has two independent parameters, an amplitude and a switching rate. We represent the noise by a set of fluctuators with fitting parameters (boundaries of switching rates), which allows us to build a desired spectral density of noise in a wide range of frequencies. We analyze the quantum dynamics and the efficiency of the ET as a function of (i) the energy gap between the donor and acceptor, (ii) the strength of the interaction with the continuum, and (iii) noise parameters. As an example, numerical results are presented for the ET through the active pathway in a quinone-type photosystem II RC.
机译:我们使用非埃尔米特哈密顿方法对光合作用中心(RC)中的量子电子转移(ET)进行建模。我们的模型包括(i)具有不连续能级的两个蛋白质辅因子,供体和受体,以及(ii)具有连续能谱的第三种蛋白质色素(吸收剂)。在供体和受体之间以及在受体和水槽之间引入了相互作用,而噪声在供体和受体之间起作用。噪声通常被认为是噪声(作为外部随机力),并由两级系统(随机波动器)的整体来描述。每个波动器具有两个独立的参数,即幅度和切换率。我们用一组具有合适参数(开关速率的边界)的波动器来表示噪声,这使我们能够在很宽的频率范围内建立所需的噪声频谱密度。我们根据(i)供体和受体之间的能隙,(ii)与连续体相互作用的强度和(iii)噪声参数来分析量子动力学和ET的效率。例如,在醌型光敏系统II RC中,通过活动路径给出了ET的数值结果。

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