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中国物理学会期刊

强关联电子体系的量子蒙特卡罗计算

CSTR: 32037.14.aps.71.20220079

Quantum Monte Carlo study of strongly correlated electrons

CSTR: 32037.14.aps.71.20220079
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  • 理解强关联电子体系是一个长期的重要目标, 该体系的魅力不仅在于其背后蕴藏着深刻的物理, 还在于其中涌现出的丰富物质态在量子调控、量子计算等领域具有巨大的潜在应用价值. 同时, 理论上非微扰地理解强关联电子体系是极其困难的, 一直充满挑战. 量子蒙特卡罗计算是一类非微扰计算的标准方法, 有助于对强关联电子体系提供非微扰的理解, 因而广泛运用于凝聚态和高能物理领域. 然而, 量子蒙特卡罗计算通常会受到负符号问题的困扰. 本文将具体介绍一些无负符号关联电子模型的设计思路, 并讨论我们近期提出的符号边界理论. 通过设计无负符号或者具有代数符号行为的强关联电子模型, 可以帮助人们研究很多重要的量子多体问题, 包括巡游磁性量子临界行为、非常规超导和磁性序的竞争, 以及莫尔(moiré)量子物质中的关联物相与相变等.

     

    Understanding strongly correlated electrons is an important long-term goal, not only for uncovering fundamental physics behind, but also for their emergence of lots of novel states which have potential applications in quantum control and quantum computations. Meanwhile, the strongly correlated electrons are usually extremely hard problems, and it is generally impossible to understand them unbiasedly. Quantum Monte Carlo is a typical unbiased numeric method, which does not depend on any perturbation, and it can help us to exactly understand the strongly correlated electrons, so that it is widely used in high energy and condensed matter physics. However, quantum Monte Carlo usually suffers from the notorious sign problem. In this paper, we introduce general ideas to design sign problem free models and discuss the sign bound theory we proposed recently. In the sign bound theory, we build a direct connection between the average sign and the ground state properties of the system. We find usually the average sign has the conventional exponential decay with system size increasing, leading to exponential complexity; but for some cases it can have algebraic decay, so that quantum Monte Carlo simulation still has polynomial complexity. By designing sign problem free or algebraic sign behaved strongly correlated electron models, we can approach to several long outstanding problems, such as the itinerant quantum criticality, the competition between unconventional superconductivity and magnetism, as well as the recently found correlated phases and phase transitions in moiré quantum matter.

     

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