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Quantum networks distributed over distances greater than a few kilometers will be limited by the time required for information to propagate between nodes. We analyze protocols that are able to circumvent this bottleneck by employing…

Characterizing multipartite quantum systems is crucial for quantum computing and many-body physics. The problem, however, becomes challenging when the system size is large and the properties of interest involve correlations among a large…

Quantum Physics · Physics 2024-04-03 Ya-Dong Wu , Yan Zhu , Yuexuan Wang , Giulio Chiribella

Differentiable models of physical systems provide a powerful platform for gradient-based algorithms, with particular impact on parameter estimation and optimal control. Quantum systems present a particular challenge for such…

Quantum Physics · Physics 2025-09-09 David L. Craig , Natalia Ares , Erik M. Gauger

The process of translating a quantum algorithm into a form suitable for implementation on a quantum computing platform is crucial but yet challenging. This entails specifying quantum operations with precision, a typically intricate task. In…

Quantum Physics · Physics 2024-08-26 M. Zomorodi , H. Amini , M. Abbaszadeh , J. Sohrabi , V. Salari , P. Plawiak

Parameterized quantum circuits (PQC, aka, variational quantum circuits) are among the proposals for a computational advantage over classical computation of near-term (not fault tolerant) digital quantum computers. PQCs have to be "trained"…

Quantum Physics · Physics 2019-04-01 Evgenii Dolzhkov , Bahman Ghandchi , Dirk Oliver Theis

We present a physically motivated strategy for the construction of training sets for transferable machine learning interatomic potentials. It is based on a systematic exploration of all possible space groups in random crystal structures,…

Materials Science · Physics 2023-03-29 Marvin Poul , Liam Huber , Erik Bitzek , Jörg Neugebauer

From the nano-scale to the macro-scale, biological tissue is spatially heterogeneous. Even when tissue behavior is well understood, the exact subject specific spatial distribution of material properties is often unknown. And, when…

Tissues and Organs · Quantitative Biology 2020-11-02 Emma Lejeune , Bill Zhao

This paper proposes a brain-inspired approach to quantum machine learning with the goal of circumventing many of the complications of other approaches. The fact that quantum processes are unitary presents both opportunities and challenges.…

Machine Learning · Computer Science 2019-05-16 Bruce MacLennan

The current generation of quantum computing technologies call for quantum algorithms that require a limited number of qubits and quantum gates, and which are robust against errors. A suitable design approach are variational circuits where…

Quantum Physics · Physics 2020-04-10 Maria Schuld , Alex Bocharov , Krysta Svore , Nathan Wiebe

We present a perspective on molecular machine learning (ML) in the field of chemical process engineering. Recently, molecular ML has demonstrated great potential in (i) providing highly accurate predictions for properties of pure components…

Chemical Physics · Physics 2025-09-01 Jan G. Rittig , Manuel Dahmen , Martin Grohe , Philippe Schwaller , Alexander Mitsos

Quantum computing offers the potential to solve certain complex problems, yet, scaling monolithic processors remains a major challenge. Modular and distributed architectures are proposed to build large-scale quantum systems while bringing…

Machine Learning Interatomic Potentials play a fundamental role in computational chemistry and materials science, enabling applications from molecular dynamics simulations to drug design and materials discovery. While recent approaches can…

Machine Learning · Computer Science 2026-05-12 Amir Masoud Nourollah , Irtaza Khalid , Stefano Leoni , Steven Schockaert

We show how techniques from machine learning and optimization can be used to find circuits of photonic quantum computers that perform a desired transformation between input and output states. In the simplest case of a single input state,…

Quantum machine learning (QML) is a rapidly growing field that combines quantum computing principles with traditional machine learning. It seeks to revolutionize machine learning by harnessing the unique capabilities of quantum mechanics…

Quantum Physics · Physics 2024-11-15 Jun Qi , Chao-Han Yang , Samuel Yen-Chi Chen , Pin-Yu Chen

We establish an isomorphism between quantum circuits and a subspace of polyatomic molecules, which suggests that molecules can be used as descriptors of quantum circuits for quantum machine learning. Our numerical results show that the…

Quantum Physics · Physics 2025-03-11 Elham Torabian , Roman V. Krems

A new concept of the molecular structure optimization method based on quantum dynamics computations is presented. Nuclei are treated as quantum mechanical particles, as are electrons, and the many-body wave function of the system is…

Variational quantum circuits are increasingly studied as continuous-function approximators, but quantum regression remains difficult to train when global losses, finite-shot stochasticity, and circuit-depth growth combine to produce weak or…

Machine Learning · Computer Science 2026-05-14 Qingyu Meng , Yangshuai Wang

Utilising dynamic electromagnetic field control over charged particles serves as the basis for a quantum machine learning platform that operates on observables rather than directly on states. Such a platform can be physically realised in…

Quantum Physics · Physics 2024-06-12 Jesús Fuentes

Any potential application of quantum computing, once encoded as a quantum circuit, needs to be compiled in order to be executed on a quantum computer. Deciding which qubit technology, which device, which compiler, and which corresponding…

Quantum Physics · Physics 2024-06-25 Nils Quetschlich , Lukas Burgholzer , Robert Wille

Within quantum machine learning, parametrized quantum circuits provide flexible quantum models, but their performance is often highly task-dependent, making manual circuit design challenging. Alternatively, quantum architecture search…