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    Tree tensor network impurity solver based on Cayley-tree mapping

    Bo Zhan1,2, Jia-Lin Chen1,2, Zhen Fan1,2, and Tao Xiang1,2,*

    • *Contact author: txiang@iphy.ac.cn

    Phys. Rev. B 113, 195144 – Published 21 May, 2026

    DOI: https://doi.org/10.1103/ycty-d5f9

    Abstract

    We introduce a tree tensor network (TTN) impurity solver that enables highly efficient and accurate real-time simulations of quantum impurity models. By decomposing a noninteracting bath Hamiltonian into a Cayley tree, the method provides a tensor-network representation that naturally captures the multiscale entanglement structure intrinsic to impurity–bath systems. This geometry differs from conventional chain-based mappings and yields a substantial reduction of entanglement, allowing accurate ground-state properties and long-time dynamics to be captured at significantly lower bond dimensions. Benchmark calculations for the single-impurity Anderson model demonstrate that the TTN solver achieves markedly enhanced resolution of real-frequency spectral functions, without invoking analytic continuation. This impurity solver provides a balanced, scale-uniform description of impurity physics and offers a versatile approach for real-time dynamical mean-field theory and related applications involving quantum impurity models.

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