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This work is concerned with tree tensor network operators (TTNOs) for representing quantum Hamiltonians. We first establish a mathematical framework connecting tree topologies with state diagrams. Based on these, we devise an algorithm for…

Quantum Physics · Physics 2024-07-09 Richard M. Milbradt , Qunsheng Huang , Christian B. Mendl

This research introduces an improved framework for constructing matrix product operators (MPOs) and tree tensor network operators (TTNOs), crucial tools in quantum simulations. A given (Hamiltonian) operator typically has a known symbolic…

Quantum Physics · Physics 2025-07-04 Hazar Çakır , Richard M. Milbradt , Christian B. Mendl

We introduce an efficient method TTN-HEOM for exactly calculating the open quantum dynamics for driven quantum systems interacting with highly structured bosonic baths by combining the tree tensor network (TTN) decomposition scheme to the…

Quantum Physics · Physics 2025-10-01 Xinxian Chen , Ignacio Franco

We develop and employ general Tree Tensor Networks (TTNs) to compute the vibrational spectra for two model systems: a set of 64-dimensional coupled oscillators and acetonitrile. We explore various tree architectures, ranging from the simple…

Chemical Physics · Physics 2025-12-19 Shuo Sun , Richard M. Milbradt , Stefan Knecht , Chandan Kumar , Christian B. Mendl

Tree tensor network states (TTNSs) combined with the density matrix renormalization group (DMRG) are emerging as powerful tools for vibrational and vibronic structure simulations in molecules with strong coupling and fluxionality. In this…

Chemical Physics · Physics 2026-05-28 Henrik R. Larsson , Brieuc Le Dé , Gino E. Gamboni

Compactly representing and efficently applying linear operators are fundamental ingredients in tensor network methods for simulating quantum many-body problems and solving high-dimensional problems in scientific computing. In this work, we…

Numerical Analysis · Mathematics 2024-05-17 Gianluca Ceruti , Daniel Kressner , Dominik Sulz

Tensor network states are an indispensable tool for the simulation of strongly correlated quantum many-body systems. In recent years, tree tensor network states (TTNS) have been successfully used for two-dimensional systems and to benchmark…

Quantum Physics · Physics 2026-01-23 Thomas Barthel

Tree tensor network (TTN) provides an essential theoretical framework for the practical simulation of quantum many-body systems, where the network structure defined by the connectivity of the isometry tensors plays a crucial role in…

Statistical Mechanics · Physics 2023-01-24 Toshiya Hikihara , Hiroshi Ueda , Kouichi Okunishi , Kenji Harada , Tomotoshi Nishino

TENSO is a versatile and powerful open-source software package for numerically exact simulations of the dynamics of quantum systems immersed in structured thermal environments. It is based on a tree tensor network decomposition of the…

We have developed TTNOpt, a software package that utilizes tree tensor networks (TTNs) for quantum spin systems and high-dimensional data analysis. TTNOpt provides efficient and powerful TTN computations by locally optimizing the network…

Quantum Physics · Physics 2026-02-06 Ryo Watanabe , Hidetaka Manabe , Toshiya Hikihara , Hiroshi Ueda

Tensor networks are used to efficiently approximate states of strongly-correlated quantum many-body systems. More generally, tensor network approximations may allow to reduce the costs for operating on an order-$N$ tensor from exponential…

Strongly Correlated Electrons · Physics 2022-05-31 Hao Chen , Thomas Barthel

A novel algorithm based on the optimized decimation of tensor networks with super-orthogonalization (ODTNS) that can be applied to simulate efficiently and accurately not only the thermodynamic but also the ground state properties of…

Statistical Mechanics · Physics 2015-06-05 Shi-Ju Ran , Wei Li , Bin Xi , Zhe Zhang , Gang Su

The hierarchical equations of motion (HEOM) method is a numerically exact open quantum system dynamics approach. The method is rooted in an exponential expansion of the bath correlation function, which in essence strategically reshapes a…

Chemical Physics · Physics 2023-06-14 Yaling Ke

We investigate tree tensor network states for quantum chemistry. Tree tensor network states represent one of the simplest generalizations of matrix product states and the density matrix renormalization group. While matrix product states…

Strongly Correlated Electrons · Physics 2013-04-09 Naoki Nakatani , Garnet Kin-Lic Chan

We propose the entanglement bipartitioning approach to design an optimal network structure of the tree-tensor-network (TTN) for quantum many-body systems. Given an exact ground-state wavefunction, we perform sequential bipartitioning of…

Quantum Physics · Physics 2023-03-02 Kouichi Okunishi , Hiroshi Ueda , Tomotoshi Nishino

We present how to compute vibrational eigenstates with tree tensor network states (TTNSs), the underlying ansatz behind the multilayer multiconfiguration time-dependent Hartree (ML-MCTDH) method. The eigenstates are computed with an…

Chemical Physics · Physics 2019-11-27 Henrik R. Larsson

Hybrid Tensor Networks (hTN) offer a promising solution for encoding variational quantum states beyond the capabilities of efficient classical methods or noisy quantum computers alone. However, their practical usefulness and many…

Matrix product states (MPS), a tensor network designed for one-dimensional quantum systems, has been recently proposed for generative modeling of natural data (such as images) in terms of `Born machine'. However, the exponential decay of…

Machine Learning · Statistics 2019-05-13 Song Cheng , Lei Wang , Tao Xiang , Pan Zhang

We investigate the disordered spin-$\frac12$Heisenberg model in two dimensions and employ tree tensor networks (TTNs) with a physics-informed structural optimization of the tree layout, to simulate dynamics in the many-body localization…

Disordered Systems and Neural Networks · Physics 2025-12-23 Lars Humpert , Dante M. Kennes , Jan-Niklas Herre

Tensor Network States (TNS) offer an efficient representation for the ground state of quantum many body systems and play an important role in the simulations of them. Numerous TNS are proposed in the past few decades. However, due to the…

Quantum Physics · Physics 2022-06-28 Xiangjian Qian , Mingpu Qin
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