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Related papers: Quantum Dynamics of Machine Learning

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This article discusses applications of Bayesian machine learning for quantum molecular dynamics. One particular formulation of quantum dynamics advocated here is in the form of a machine learning simulator of the Schr\"{o}dinger equation.…

Chemical Physics · Physics 2019-07-24 R. V. Krems

The fundamental principle of quantum mechanics is that the probabilities of physical outcomes are obtained from the intermediate states and processes of the interacting particles, considered as happening concurrently. When the interaction…

General Physics · Physics 2011-01-18 Spyros Efthimiades

In this work we explore how quantum scientific machine learning can be used to tackle the challenge of weather modelling. Using parameterised quantum circuits as machine learning models, we consider two paradigms: supervised learning from…

Simulating fluid dynamics on a quantum computer is intrinsically difficult due to the nonlinear and non-Hamiltonian nature of the Navier-Stokes equation (NSE). We propose a framework for quantum computing of fluid dynamics based on the…

Fluid Dynamics · Physics 2024-01-05 Zhaoyuan Meng , Yue Yang

We introduce a unified framework -- Quantum Neural Ordinary and Partial Differential Equations (QNODEs and QNPDEs) -- which extends the continuous-time formalism of classical neural ordinary and partial differential equations into quantum…

Quantum Physics · Physics 2026-01-13 Yu Cao , Shi Jin , Nana Liu

We present an approach to simulate the Schr\"odinger equation through continuous time quantum walks. The CTQW-based simulation applies unitary evolution driven by a quantum walk to generate probability amplitude distributions at various…

Quantum Physics · Physics 2025-09-16 Rachana Soni , Navneet Pratap Singh

In this paper we apply quantum hydrodynamics (QHD) to study the quantum evolution of a system of spinning particles and particles that have the electric dipole moments EDM in the rotating reference frame. The method presented is based on…

Plasma Physics · Physics 2016-12-21 Mariya Iv. Trukhanova

In this letter, by establishing the Schr\"odinger equation of the optimization problem, the optimization problem is transformed into a constrained state quantum problem with the objective function as the potential energy. The mathematical…

Quantum Physics · Physics 2021-10-12 Peng Wang , Gang Xin , Yuwei Jiao

Within the past few years, we have witnessed the rising of quantum machine learning (QML) models which infer electronic properties of molecules and materials, rather than solving approximations to the electronic Schrodinger equation. The…

Chemical Physics · Physics 2018-07-17 Bing Huang , Nadine O. Symonds , O. Anatole von Lilienfeld

The semiclassically scaled time-dependent multi-particle Schr\"odinger equation describes, inter alia, quantum dynamics of nuclei in a molecule. It poses the combined computational challenges of high oscillations and high dimensions. This…

Numerical Analysis · Mathematics 2020-12-02 Caroline Lasser , Christian Lubich

We solve the time-dependent Schr\"odinger equation by learning the score function, the gradient of the log-probability density, on Bohmian trajectories. In Bohm's formulation of quantum mechanics, particles follow deterministic paths under…

Quantum Physics · Physics 2026-04-29 Lei Wang

It was recently shown that the Madelung equations, that is, a hydrodynamic form of the Schr\"odinger equation, can be derived from a canonical ensemble of neural networks where the quantum phase was identified with the free energy of hidden…

Quantum Physics · Physics 2021-10-13 Mikhail I. Katsnelson , Vitaly Vanchurin

The ability to perform ab initio molecular dynamics simulations using potential energies calculated on quantum computers would allow virtually exact dynamics for chemical and biochemical systems, with substantial impacts on the fields of…

One of the key challenges in quantum machine learning is finding relevant machine learning tasks with a provable quantum advantage. A natural candidate for this is learning unknown Hamiltonian dynamics. Here, we tackle the supervised…

Quantum Physics · Physics 2025-06-23 Alice Barthe , Mahtab Yaghubi Rad , Michele Grossi , Vedran Dunjko

Simulating and predicting dynamics of quantum many-body systems is extremely challenging, even for state-of-the-art computational methods, due to the spread of entanglement across the system. However, in the long-wavelength limit, quantum…

The core objective of machine-assisted scientific discovery is to learn physical laws from experimental data without prior knowledge of the systems in question. In the area of quantum physics, making progress towards these goals is…

Quantum Physics · Physics 2023-01-09 Matthew Choi , Daniel Flam-Shepherd , Thi Ha Kyaw , Alán Aspuru-Guzik

We introduce a class of neural controlled differential equation inspired by quantum mechanics. Neural quantum controlled differential equations (NQDEs) model the dynamics by analogue of the Schr\"{o}dinger equation. Specifically, the hidden…

Machine Learning · Computer Science 2024-12-19 Lingyi Yang , Zhen Shao

The increasing focus on long-term time series prediction across various fields has been significantly strengthened by advancements in quantum computation. In this paper, we introduce a data-driven method designed for time series prediction…

Quantum Extreme Learning Machine (QELM) is an emerging hybrid quantum machine learning framework that leverages quantum system dynamics to enhance classical models. However, QELM can suffer from the exponential concentration problem, where…

Quantum Physics · Physics 2026-04-24 Payal D. Solanki , Anh Pham

Quantum scattering calculations for all but low-dimensional systems at low energies must rely on approximations. All approximations introduce errors. The impact of these errors is often difficult to assess because they depend on the…

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