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TeNPy (short for 'Tensor Network Python') is a python library for the simulation of strongly correlated quantum systems with tensor networks. The philosophy of this library is to achieve a balance of readability and usability for…

The study of complex many-body systems via analysis of the trajectories of the units that dynamically move and interact within them is a non-trivial task. The workflow for extracting meaningful information from the raw trajectory data is…

Materials Science · Physics 2025-10-31 Simone Martino , Matteo Becchi , Andrew Tarzia , Daniele Rapetti , Giovanni M. Pavan

Hydrodynamical simulations are increasingly able to accurately model physical systems on stellar, galactic, and cosmological scales, however, the utility of these simulations is often limited by our ability to directly compare them with the…

Instrumentation and Methods for Astrophysics · Physics 2017-09-26 Cameron Hummels , Britton Smith , Devin Silvia

Real-world time series often exhibit strong non-stationarity, complex nonlinear dynamics, and behavior expressed across multiple temporal scales, from rapid local fluctuations to slow-evolving long-range trends. However, many contemporary…

Machine Learning · Computer Science 2026-05-19 Sumit S Shevtekar , Chandresh K Maurya

TeNeS (Tensor Network Solver) is a free/libre open-source software program package for calculating two-dimensional many-body quantum states based on the tensor network method and the corner transfer matrix renormalization group (CTMRG)…

Strongly Correlated Electrons · Physics 2022-06-17 Yuichi Motoyama , Tsuyoshi Okubo , Kazuyoshi Yoshimi , Satoshi Morita , Takeo Kato , Naoki Kawashima

Machine learning has emerged as a promising paradigm to study the quantum dissipative dynamics of open quantum systems. To facilitate the use of our recently published ML-based approaches for quantum dissipative dynamics, here we present an…

Chemical Physics · Physics 2024-03-19 Arif Ullah , Pavlo O. Dral

Small and wide angle x-ray scattering tensor tomography are powerful methods for studying anisotropic nanostructures in a volume-resolved manner, and are becoming increasingly available to users of synchrotron facilities. The analysis of…

Materials Science · Physics 2025-04-24 Leonard C. Nielsen , Mads Carlsen , Sici Wang , Arthur Baroni , Torne Tänzer , Marianne Liebi , Paul Erhart

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

Reliable real-time estimation of atmospheric turbulence intensity remains an open challenge for aircraft operating across diverse altitude bands, particularly over oceanic, polar, and data-sparse regions that lack operational nowcasting…

Machine Learning · Computer Science 2026-03-10 Boris Kriuk , Fedor Kriuk

We present MiniTensor, an open source tensor operations library that focuses on minimalism, correctness, and performance. MiniTensor exposes a familiar PyTorch-like Python API while it executes performance critical code in a Rust engine.…

Machine Learning · Computer Science 2026-02-03 Soumyadip Sarkar

We present an open-source software package called "Hamiltonian Open Quantum System Toolkit" (HOQST), a collection of tools for the investigation of open quantum system dynamics in Hamiltonian quantum computing, including both quantum…

Quantum Physics · Physics 2022-07-01 Huo Chen , Daniel A. Lidar

Generation and analysis of time-series data is relevant to many quantitative fields ranging from economics to fluid mechanics. In the physical sciences, structures such as metastable and coherent sets, slow relaxation processes, collective…

The thermodynamic binding networks (TBN) model is a tool for studying engineered molecular systems. The TBN model allows one to reason about their behavior through a simplified abstraction that ignores details about molecular composition,…

Emerging Technologies · Computer Science 2021-05-13 David Haley , David Doty

This paper puts forward the vision of creating a library of neural-network-based models for power system simulations. Traditional numerical solvers struggle with the growing complexity of modern power systems, necessitating faster and more…

Systems and Control · Electrical Eng. & Systems 2025-02-11 Ioannis Karampinis , Petros Ellinas , Ignasi Ventura Nadal , Rahul Nellikkath , Spyros Chatzivasileiadis

We investigate strategies for simulating open quantum systems coupled to dissipative baths by comparing explicit wave function-based discretization [via multi-layer multi-configuration time-dependent Hartree (ML-MCTDH)] and the implicit…

Quantum Physics · Physics 2026-01-21 Xinxian Chen , Ignacio Franco

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

Numerical simulations are a powerful tool to study quantum systems beyond exactly solvable systems lacking an analytic expression. For one-dimensional entangled quantum systems, tensor network methods, amongst them Matrix Product States…

Quantum Gases · Physics 2018-02-28 Daniel Jaschke , Michael L. Wall , Lincoln D. Carr

We present TDS Simulator, a new software tool aimed at modelling thermal desorption spectroscopy (TDS) experiments. TDS is a widely used technique for quantifying key characteristics of hydrogen-material interactions, such as diffusivity…

Computational Engineering, Finance, and Science · Computer Science 2024-11-05 E. García-Macías , Z. D. Harris , E. Martínez-Pañeda

We present OpenMM-Python-Force, a plugin designed to extend OpenMM's functionality by enabling integration of energy and force calculations from external Python programs via a callback mechanism. During molecular dynamics simulations, data…

Computational Physics · Physics 2024-12-25 Zhi Wang , Wen Yan

We introduce a general numerical method to compute dynamics and multi-time correlations of chains of quantum systems, where each system may couple strongly to a structured environment. The method combines the process tensor formalism for…

Quantum Physics · Physics 2023-08-16 Gerald E. Fux , Dainius Kilda , Brendon W. Lovett , Jonathan Keeling