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arXiv 2504.08068quant-ph
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检验开放量子动力学模拟中的浴相关函数

Testing bath correlation functions for open quantum dynamics simulations

Masaaki Tokieda

AI总结:

本文提出了一种评估开放量子动力学模拟中近似浴相关函数有效性的测试框架,通过谐振子系统和双自旋系统验证了方法的准确性,并指出了亚Ohmic谱密度在有限温度下的挑战。

摘要:

准确模拟开放量子系统中的热化过程需要可靠地表示浴相关函数(BCF)。数值方法,如层次方程运动和伪模方法,本质上使用有限函数集近似BCF,这可能影响模拟精度。在本工作中,我们提出了一种实用且严谨的测试框架,以评估开放量子动力学模拟中近似BCF的有效性。我们的方法采用谐振子系统,其中计算的动力学可以与已知的精确解进行比对。为了实现实用测试,我们进行了两个关键的方法学改进。首先,我们开发了数值技术,以高效评估这些精确解在广泛BCF范围内的表现,确保广泛适用性。其次,我们引入了基于矩的状态表示法,通过利用系统的高斯性质显著简化计算。对双自旋系统和Transmon谐振器系统的应用表明,我们的测试程序提供的误差估计能够捕捉热化模拟中观察到的定性趋势。使用这种方法,我们评估了最近提出的BCF构造方法的性能,突显了它们的优势以及在有限温度下亚Ohmic谱密度带来的显著挑战。

英文摘要:

Accurate simulations of thermalization in open quantum systems require a reliable representation of the bath correlation function (BCF). Numerical approaches, such as the hierarchical equations of motion and the pseudomode method, inherently approximate the BCF using a finite set of functions, which can impact simulation accuracy. In this work, we propose a practical and rigorous testing framework to assess the validity of approximate BCFs in open quantum dynamics simulations. Our approach employs a harmonic oscillator system, where the computed dynamics can be benchmarked against known exact solutions. To enable practical testing, we make two key methodological advancements. First, we develop numerical techniques to efficiently evaluate these exact solutions across a wide range of BCFs, ensuring broad applicability. Second, we introduce a moment-based state representation that significantly simplifies computations by exploiting the Gaussian nature of the system. Applications to a two-spin system and a transmon-resonator system demonstrate that our testing procedure provides error estimates that capture the qualitative trends observed in thermalization simulations. Using this methodology, we assess the performance of recently proposed BCF construction methods, highlighting both their strengths and a notable challenge posed by sub-Ohmic spectral densities at finite temperatures.

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