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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…

Adaptive variational quantum simulation algorithms use information from the quantum computer to dynamically create optimal trial wavefunctions for a given problem Hamiltonian. A key ingredient in these algorithms is a predefined operator…

We derive and analyze a generic, recursive algorithm for estimating all splits in a finite cluster tree as well as the corresponding clusters. We further investigate statistical properties of this generic clustering algorithm when it…

Machine Learning · Statistics 2021-11-02 Ingo Steinwart , Bharath K. Sriperumbudur , Philipp Thomann

Connecting multiple smaller qubit modules by generating high-fidelity entangled states is a promising path for scaling quantum computing hardware. The performance of such a modular quantum computer is highly dependent on the quality and…

We consider 1-qubit mixed quantum state estimation by adaptively updating measurements according to previously obtained outcomes and measurement settings. Updates are determined by the average-variance-optimality (A-optimality) criterion,…

Quantum Physics · Physics 2012-05-21 Takanori Sugiyama , Peter S. Turner , Mio Murao

Quasi-one-dimensional quantum structures with spectra scaling faster than the square of the eigenmode number (superscaling) can generate intrinsic, off-resonant optical nonlinearities near the fundamental physical limits, independent of the…

Optics · Physics 2015-10-28 Rick Lytel , Sean M. Mossman , Mark G. Kuzyk

Broken rotational and translational symmetries are the hallmarks of solid state materials. In contrast, quantum liquids and gases do not exhibit such properties. However, if we regard the logarithm of the absolute square of a quantum liquid…

Quantum Gases · Physics 2021-07-26 Tin-Lun Ho , Saad Khalid

The relative power of quantum algorithms, using an adaptive access to quantum devices, versus classical post-processing methods that rely only on an initial quantum data set, remains the subject of active debate. Here, we present evidence…

Quantum Physics · Physics 2025-10-02 Oleksandr Kyriienko , Chukwudubem Umeano , Zoë Holmes

In this letter we revisit the problem of optimal design of quantum tomographic experiments. In contrast to previous approaches where an optimal set of measurements is decided in advance of the experiment, we allow for measurements to be…

Quantum Physics · Physics 2017-02-28 Ferenc Huszár , Neil M. T. Houlsby

Owing to the computational complexity of electronic structure algorithms running on classical digital computers, the range of molecular systems amenable to simulation remains tightly circumscribed even after many decades of work. Quantum…

Quantum Physics · Physics 2022-05-18 Alexis Ralli , Michael I. Williams , Peter V. Coveney

A scheme for coherent manipulation of collective atomic states is developed such that total subradiant states, in which spontaneous emission is suppressed into all directions due to destructive interference between neighbor atoms, can be…

Quantum Physics · Physics 2009-11-13 Alexey Kalachev

We present a genetic algorithm for the atomistic design and global optimisation of substitutionally disordered bulk materials and surfaces. Premature convergence which hamper conventional genetic algorithms due to problems with…

Materials Science · Physics 2008-09-10 Chris E. Mohn , Walter Kob

Adaptive feedback schemes are promising for quantum-enhanced measurements yet are complicated to design. Machine learning can autonomously generate algorithms in a classical setting. Here we adapt machine learning for quantum information…

Quantum Physics · Physics 2010-02-25 Alexander Hentschel , Barry C. Sanders

Developing quantum algorithms adaptive to specific constraints of near-term devices is an essential step towards practical quantum advantage. In a recent work [Phys. Rev. Lett. 131, 103601(2023)], we show cold atoms in an optical cavity can…

Quantum Physics · Physics 2024-06-12 Yuchen Luo , Xiaopeng Li , Jian Lin

We consider the problem of optimization of an effective trapping potential in a nanostructure with a quasi-one-dimensional geometry. The optimization is performed to achieve certain target optical properties of the system. We formulate and…

Materials Science · Physics 2015-05-13 Ilya Grigorenko , Herschel Rabitz , Alaxander Balatsky

Quantum computing is a new way of data processing based on the concept of quantum mechanics. Quantum circuit design is a process of converting a quantum gate to a series of basic gates and is divided into two general categories based on the…

Emerging Technologies · Computer Science 2017-03-16 Moein Sarvaghad-Moghaddam

In this work we investigate methods to improve the efficiency and scalability of quantum algorithms for quantum chemistry applications. We propose a transformation of the electronic structure Hamiltonian in the second quantization framework…

Various applications of quantum algebraic techniques in nuclear structure physics, such as the su$_q$(2) rotator model and its extensions, the use of deformed bosons in the description of pairing correlations, and the construction of…

Nuclear Theory · Physics 2008-02-03 Dennis Bonatsos , C. Daskaloyannis , P. Kolokotronis , D. Lenis

The ability of quantum computers to overcome the exponential memory scaling of many-body problems is expected to transform quantum chemistry. Quantum algorithms require accurate representations of electronic states on a quantum device, but…

Chemical Physics · Physics 2024-04-26 Hugh G. A. Burton

Hybrid quantum-classical approaches offer potential solutions to quantum chemistry problems, yet they often manifest as constrained optimization problems. Here, we explore the interconnection between constrained optimization and generalized…

Quantum Physics · Physics 2025-03-27 Muqing Zheng , Bo Peng , Ang Li , Xiu Yang , Karol Kowalski