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Related papers: Adaptive Basis Sets for Practical Quantum Computin…

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Near-term quantum computers will be limited in the number of qubits on which they can process information as well as the depth of the circuits that they can coherently carry out. To-date, experimental demonstrations of algorithms such as…

Chemical Physics · Physics 2023-10-18 Joel Bierman , Yingzhou Li , Jianfeng Lu

Adaptive techniques have important potential for wide applications in enhancing precision of quantum parameter estimation. We present a recursively adaptive quantum state tomography (RAQST) protocol for finite dimensional quantum systems…

A general procedure for the optimization of atomic density-fitting basis functions is designed with the balance between accuracy and numerical stability in mind. Given one-electron wavefunctions and energies, weights are assigned to the…

Chemical Physics · Physics 2020-10-13 Dimitri N. Laikov

Quantum computers have the potential to solve some important industrial and scientific problems with greater efficiency than classical computers. While most current realizations focus on two-level qubits, the underlying physics used in most…

Quantum Physics · Physics 2023-01-06 Kevin Mato , Martin Ringbauer , Stefan Hillmich , Robert Wille

We investigate schemes for Hamiltonian parameter estimation of a two-level system using repeated measurements in a fixed basis. The simplest (Fourier based) schemes yield an estimate with a mean square error (MSE) that decreases at best as…

We consider hierarchically implemented quantum error correction (HI-QEC), in which the fidelities of logical qubits are differentially optimized to enhance the capabilities of quantum devices in scientific applications. By employing qubit…

Quantum Physics · Physics 2022-01-05 Natalie Klco , Martin J. Savage

We perform several numerical studies for our recently published adaptive compressive tomography scheme [D. Ahn et al. Phys. Rev. Lett. 122, 100404 (2019)], which significantly reduces the number of measurement settings to unambiguously…

Quantum Physics · Physics 2019-07-31 D. Ahn , Y. S. Teo , H. Jeong , D. Koutny , J. Rehacek , Z. Hradil , G. Leuchs , L. L. Sanchez-Soto

A massive gap exists between current quantum computing (QC) prototypes, and the size and scale required for many proposed QC algorithms. Current QC implementations are prone to noise and variability which affect their reliability, and yet…

Ensembles of composite quantum states can exhibit nonlocal behaviour in the sense that their optimal discrimination may require global operations. Such an ensemble containing N pairwise orthogonal pure states, however, can always be…

This paper explores an efficient method for entanglement quantification in two-qubit and qubit-qutrit quantum systems based upon the framework of collective measurements in conjunction with machine learning. We introduce an adaptive…

Quantum Physics · Physics 2026-03-27 Martin Zeman , Vojtěch Trávníček , Antonín Černoch , Jan Soubusta , Karel Lemr

An approximate relativistic two-component Hamiltonian for use in molecular electronic structure calculations is derived in the form of a sum of fixed atom-centered kinetic and spin-orbit operators added to the non-relativistic Hamiltonian.…

Chemical Physics · Physics 2019-02-13 Dimitri N. Laikov

We present quantum algorithms, for Hamiltonians of linear combinations of local unitary operators, for Hamiltonian matrix-vector products and for preconditioning with the inverse of shifted reduced Hamiltonian operator that contributes to…

Quantum Physics · Physics 2020-09-09 Zhiyong Zhang

The near-term utility of quantum computers is hindered by hardware constraints in the form of noise. One path to achieving noise resilience in hybrid quantum algorithms is to decrease the required circuit depth -- the number of applied…

Quantum Physics · Physics 2024-04-18 Erika Magnusson , Aaron Fitzpatrick , Stefan Knecht , Martin Rahm , Werner Dobrautz

Near-term quantum computers are primarily limited by errors in quantum operations (or gates) between two quantum bits (or qubits). A physical machine typically provides a set of basis gates that include primitive 2-qubit (2Q) and 1-qubit…

Near term quantum computers suffer from the presence of different noise sources. In order to mitigate for this effect and acquire results with significantly better accuracy, there is the urge of designing efficient error correction or error…

Electronic structure methods for accurate calculation of molecular properties have a high cost that grows steeply with the problem size, therefore, it is helpful to have the underlying atomic basis functions that are less in number but of…

Chemical Physics · Physics 2019-03-15 Dimitri N. Laikov

Quantum chemistry calculations are often performed using atom-centered basis sets which are chosen to balance accuracy and cost. While they are systematically improvable, the total energy converges slowly with basis set size towards the…

Chemical Physics · Physics 2026-05-18 Nicolas Grimblat , Gabriel Klassen , Guido Falk von Rudorff

Recently, we have proposed the adaptive local basis set for electronic structure calculations based on Kohn-Sham density functional theory in a pseudopotential framework. The adaptive local basis set is efficient and systematically…

Computational Physics · Physics 2015-10-23 Gaigong Zhang , Lin Lin , Wei Hu , Chao Yang , John E. Pask

The description of weakly bound electronic states is especially difficult with atomic orbital basis sets. The diffuse atomic basis functions that are necessary to describe the extended electronic state generate significant linear…

Chemical Physics · Physics 2019-12-30 Susi Lehtola

Advancements in quantum computing underscore the critical need for sophisticated qubit readout techniques to accurately discern quantum states. This abstract presents our research intended for optimizing readout pulse fidelity for 2D and 3D…

Quantum Physics · Physics 2024-08-05 Hans Johnson , Nicholas Bornman , Taeyoon Kim , David Van Zanten , Silvia Zorzetti , Jafar Saniie