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We describe a simple method to find the ground state energy without calculating the expectation value of the Hamiltonian in the time-evolving block decimation algorithm with tensor network states. For example, we consider quantum…

Strongly Correlated Electrons · Physics 2013-05-31 Myung-Hoon Chung

With the increasing adoption of machine learning tools like neural networks across several domains, interesting connections and comparisons to concepts from other domains are coming to light. In this work, we focus on the class of Tensor…

Machine Learning · Computer Science 2020-04-22 Raghavendra Selvan , Erik B Dam

The rapid pace of recent advancements in numerical computation, notably the rise of GPU and TPU hardware accelerators, have allowed tensor network (TN) algorithms to scale to even larger quantum simulation problems, and to be employed more…

Quantum Physics · Physics 2022-09-02 Manuel S. Rudolph , Jing Chen , Jacob Miller , Atithi Acharya , Alejandro Perdomo-Ortiz

Tensor network states (TNS) are a powerful approach for the study of strongly correlated quantum matter. The curse of dimensionality is addressed by parametrizing the many-body state in terms of a network of partially contracted tensors.…

Quantum Physics · Physics 2022-08-03 Thomas Barthel , Jianfeng Lu , Gero Friesecke

In this book, we provide a comprehensive introduction to the most recent advances in the application of machine learning methods in quantum sciences. We cover the use of deep learning and kernel methods in supervised, unsupervised, and…

Tensor network techniques are becoming increasingly popular tools to solve partial differential equations within the so-called quantics representation. Their popularity stems from the fact that their spatial resolution depends only…

Quantum Physics · Physics 2026-04-13 Jheng-Wei Li , Nicolas Jolly , Xavier Waintal

We have studied transition metal clusters from a quantum information theory perspective using the density-matrix renormalization group (DMRG) method. We demonstrate the competition between entanglement and interaction localization. We also…

Quantum Physics · Physics 2015-05-19 G. Barcza , Ö. Legeza , K. H. Marti , M. Reiher

Tensor network states and parton wave functions are two pivotal methods for studying quantum many-body systems. This work connects these two subjects as we demonstrate that a variety of parton wave functions, such as projected Fermi sea and…

Strongly Correlated Electrons · Physics 2020-06-22 Ying-Hai Wu , Lei Wang , Hong-Hao Tu

The frontier of quantum computing (QC) simulation on classical hardware is quickly reaching the hard scalability limits for computational feasibility. Nonetheless, there is still a need to simulate large quantum systems classically, as the…

Quantum Physics · Physics 2025-06-23 Marzio Vallero , Flavio Vella , Paolo Rech

In stochastic modeling, there has been a significant effort towards finding predictive models that predict a stochastic process' future using minimal information from its past. Meanwhile, in condensed matter physics, matrix product states…

Quantum Physics · Physics 2019-02-05 Chengran Yang , Felix C. Binder , Varun Narasimhachar , Mile Gu

The widely used density matrix renormalization group (DRMG) method often fails to converge in systems with multiple length scales, such as lattice discretizations of continuum models and dilute or weakly doped lattice models. The local…

Quantum Gases · Physics 2012-07-17 M. Dolfi , B. Bauer , M. Troyer , Z. Ristivojevic

This is a set of lectures on tensor networks with a strong emphasis on the core algorithms involving Matrix Product States (MPS) and Matrix Product Operators (MPO). Compared to other presentations, particular care has been given to…

Quantum Physics · Physics 2026-01-07 Xavier Waintal , Chen-How Huang , Christoph W. Groth

We propose an efficient numerical method, which combines the advantages of recently developed tensor-network based methods and standard trial wave functions, to study the ground state properties of quantum many-body systems. In this…

Strongly Correlated Electrons · Physics 2015-05-22 Olga Sikora , Hsueh-Wen Chang , Chung-Pin Chou , Frank Pollmann , Ying-Jer Kao

Tensor networks provide an efficient approximation of operations involving high dimensional tensors and have been extensively used in modelling quantum many-body systems. More recently, supervised learning has been attempted with tensor…

Computer Vision and Pattern Recognition · Computer Science 2021-07-02 Raghavendra Selvan , Erik B Dam , Jens Petersen

Projected entangled-pair states (PEPS) have become a powerful tool for studying quantum many-body systems in the condensed matter and quantum materials context, particularly with advances in variational energy optimization methods. A key…

Strongly Correlated Electrons · Physics 2025-06-10 Jan Naumann , Erik Lennart Weerda , Jens Eisert , Matteo Rizzi , Philipp Schmoll

Deep learning techniques have opened a new venue for electronic structure theory in recent years. In contrast to traditional methods, deep neural networks provide much more expressive and flexible wave function ansatz, resulting in better…

Chemical Physics · Physics 2021-09-08 Xiang Li , Cunwei Fan , Weiluo Ren , Ji Chen

We present a deterministic optimization framework for Neural Network Quantum States (NQS) designed to bypass the sampling variance and slow mixing issues inherent in stochastic optimization. By projecting a neural backflow ansatz onto…

Chemical Physics · Physics 2026-05-12 Zheng Che

This article compares the tensor method density matrix renormalization group (DMRG) with two neural network based methods -namely FermiNet and PauliNet) for determining the ground state wavefunction of the many-body electronic…

Optimization and Control · Mathematics 2024-12-05 Mathias Dus , Geneviève Dusson , Virginie Ehrlacher , Clément Guillot , Joel Pascal Soffo Wambo

The development of efficient machine learning models for molecular systems representation is becoming crucial in scientific research. We introduce TensorNet, an innovative O(3)-equivariant message-passing neural network architecture that…

Machine Learning · Computer Science 2023-10-31 Guillem Simeon , Gianni de Fabritiis

We find an efficient approach to approximately convert matrix product states (MPSs) into restricted Boltzmann machine wave functions consisting of a multinomial hidden unit through a canonical polyadic (CP) decomposition of the MPSs. This…

Strongly Correlated Electrons · Physics 2025-10-29 Ryui Kaneko , Shimpei Goto
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