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The precise description of quantum nuclear fluctuations in atomistic modelling is possible by employing path integral techniques, which involve a considerable computational overhead due to the need of simulating multiple replicas of the…

Chemical Physics · Physics 2017-03-23 Venkat Kapil , Jörg Behler , Michele Ceriotti

Quantum simulation algorithms often require numerous ancilla qubits and deep circuits, prohibitive for near-term hardware. We introduce a framework for simulating quantum channels using ensembles of low-depth circuits in place of many-qubit…

Quantum Physics · Physics 2024-08-01 Joseph Peetz , Scott E. Smart , Prineha Narang

The promise of universal quantum computing requires scalable single- and inter-qubit control interactions. Currently, three of the leading candidate platforms for quantum computing are based on superconducting circuits, trapped ions, and…

Quantum Physics · Physics 2023-05-02 Eun Oh , Xuanying Lai , Jianming Wen , Shengwang Du

A primary objective of quantum computation is to efficiently simulate quantum physics. Scientifically and technologically important quantum Hamiltonians include those with spin-$s$, vibrational, photonic, and other bosonic degrees of…

Quantum Physics · Physics 2020-12-11 Nicolas P. D. Sawaya , Gian Giacomo Guerreschi , Adam Holmes

The variational quantum eigensolver is one of the most promising algorithms for near-term quantum computers. It has the potential to solve quantum chemistry problems involving strongly correlated electrons, which are otherwise difficult to…

Quantum Physics · Physics 2023-07-18 Luogen Xu , James K. Freericks

In this paper, we discuss extending the sub-system embedding sub-algebra coupled cluster (SESCC) formalism and the double unitary coupled cluster (DUCC) Ansatz to the time domain. An important part of the analysis is associated with proving…

Quantum Physics · Physics 2020-07-15 Karol Kowalski , Nicholas P. Bauman

Distributed quantum computing (DQC) is a promising technique for scaling up quantum systems. While significant progress has been made in DQC for quantum circuit models, there exists much less research on DQC for measurement-based quantum…

Quantum Physics · Physics 2026-01-05 Yecheng Xue , Rui Yang , Zhiding Liang , Tongyang Li

Quantum computers have the potential to simulate chemical systems beyond the capability of classical computers. Recent developments in hybrid quantum-classical approaches enable the determinations of the ground or low energy states of…

Quantum Physics · Physics 2021-12-06 Chee-Kong Lee , Jonathan Wei Zhong Lau , Liang Shi , Leong Chuan Kwek

Despite its simplicity and strong theoretical guarantees, adiabatic state preparation has received considerably less interest than variational approaches for the preparation of low-energy electronic structure states. Two major reasons for…

Quantum Physics · Physics 2025-02-19 Etienne Granet , Khaldoon Ghanem , Henrik Dreyer

Progress in the realm of quantum technologies is paving the way for a multitude of potential applications across different sectors. However, the reduced number of available quantum computers, their technical limitations and the high demand…

We present high-precision quantum computing simulations of three-body atoms (He, H$^-$) and molecules (H$_2^+$, HD$^+$), the latter being studied beyond the Born-Oppenheimer approximation. The Non-Iterative Disentangled Unitary Coupled…

Quantum Physics · Physics 2025-10-22 Mohammad Haidar , Hugo D. Nogueira , J. -Ph. Karr

Quantum chemistry provides key applications for near-term quantum computing, but these are greatly complicated by the presence of noise. In this work we present an efficient ansatz for the computation of two-electron atoms and molecules…

Quantum Physics · Physics 2020-04-23 Scott E. Smart , David A. Mazziotti

Limited quantum memory is one of the most important constraints for near-term quantum devices. Understanding whether a small quantum computer can simulate a larger quantum system, or execute an algorithm requiring more qubits than…

Quantum Physics · Physics 2020-12-10 Tianyi Peng , Aram Harrow , Maris Ozols , Xiaodi Wu

Applying quantum chemistry algorithms to large-scale systems requires substantial computational resources scaled with the system size and the desired accuracy. To address this, ByteQC, a fully-functional and efficient package for…

We propose an efficient protocol for digital quantum simulation of quantum chemistry problems and enhanced digital-analog quantum simulation of transport phenomena in biomolecules with superconducting circuits. Along these lines, we…

Quantum Physics · Physics 2016-06-23 L. García-Álvarez , U. Las Heras , A. Mezzacapo , M. Sanz , E. Solano , L. Lamata

We develop three new methods to implement any Linear Combination of Unitaries (LCU), a powerful quantum algorithmic tool with diverse applications. While the standard LCU procedure requires several ancilla qubits and sophisticated…

Quantum Physics · Physics 2024-10-16 Shantanav Chakraborty

Entanglement is widely believed to lie at the heart of the advantages offered by a quantum computer. This belief is supported by the discovery that a noiseless (pure) state quantum computer must generate a large amount of entanglement in…

Quantum Physics · Physics 2008-11-16 B. P. Lanyon , M. Barbieri , M. P. Almeida , A. G. White

We simulate the time evolution of collective neutrino oscillations in two-flavor settings on a quantum computer. We explore the generalization of Trotter-Suzuki approximation to time-dependent Hamiltonian dynamics. The trotterization steps…

Quantum Physics · Physics 2023-08-21 Pooja Siwach , Kaytlin Harrison , A. Baha Balantekin

Randomized algorithms are crucial subroutines in quantum computing, but the requirement to execute many types of circuits on a real quantum device has been challenging to their extensive implementation. In this study, we propose an…

Quantum Physics · Physics 2026-04-23 Shu Kanno , Ikko Hamamura , Rudy Raymond , Qi Gao , Naoki Yamamoto

Dissipation can be used as a resource to control and simulate quantum systems. We discuss a modular model based on fast dissipation capable of performing universal quantum computation, and simulating arbitrary Lindbladian dynamics. The…

Quantum Physics · Physics 2016-12-01 Jeffrey Marshall , Lorenzo Campos Venuti , Paolo Zanardi