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Approximate full configuration interaction (FCI) calculations have recently become tractable for systems of unforeseen size thanks to stochastic and adaptive approximations to the exponentially scaling FCI problem. The result of an FCI…

强关联电子 · 物理学 2017-10-25 Susi Lehtola , Norm M. Tubman , K. Birgitta Whaley , Martin Head-Gordon

The recent quantum information boom has effected a resurgence of interest in unitary coupled cluster (UCC) theory. Our group's interest in local energy landscapes of unitary ans\"atze prompted us to investigate the classical approach of…

化学物理 · 物理学 2022-11-01 Harper R. Grimsley , Nicholas J. Mayhall

We present a new method for state preparation using the Unitary Vibrational Coupled-Cluster (UVCC) technique. Our approach utilizes redundancies in the Hilbert space in the direct mapping of vibrational modes into qubits. By eliminating…

量子物理 · 物理学 2024-12-06 Michal Szczepanik , Emil Zak

The factorized form of the unitary coupled cluster ansatz is a popular state preparation ansatz for electronic structure calculations of molecules on quantum computers. It often is viewed as an approximation (based on the Trotter product…

化学物理 · 物理学 2022-02-16 Jia Chen , Hai-Ping Cheng , J. K. Freericks

Unitary Coupled Cluster (UCC) approaches are an appealing route to utilising quantum hardware to perform quantum chemistry calculations, as quantum computers can in principle perform UCC calculations in a polynomially scaling fashion, as…

量子物理 · 物理学 2022-06-15 Maria-Andreea Filip , Nathan Fitzpatrick , David Muñoz Ramo , Alex J. W. Thom

Tailored coupled cluster theory represents a computationally inexpensive way to describe static and dynamical electron correlation effects. In this work, we scrutinize the performance of various tailored coupled cluster methods externally…

化学物理 · 物理学 2021-03-24 Aleksandra Leszczyk , Mihály Máté , Örs Legeza , Katharina Boguslawski

The critical value of the atom-field coupling strength for a finite number of atoms is deter- mined by means of both, semiclassical and exact solutions. In the semiclassical approach we use a variational procedure with coherent and…

量子物理 · 物理学 2012-12-05 Octavio Castaños , Eduardo Nahmad-Achar , Ramón López-Peña , Jorge G. Hirsch

We show that it is possible to clone quantum states to arbitrary accuracy in the presence of a Deutschian closed timelike curve (D-CTC), with a fidelity converging to one in the limit as the dimension of the CTC system becomes large---thus…

量子物理 · 物理学 2014-07-31 Todd A. Brun , Mark M. Wilde , Andreas Winter

We prove the unitarity of the Euclidean nonlocal scalar field theory to all perturbative orders in the loop expansion. The amplitudes in the Euclidean space are calculated assuming that all the particles have purely imaginary energies, and…

广义相对论与量子宇宙学 · 物理学 2019-05-29 Fabio Briscese , Leonardo Modesto

The ground state pairing correlations in finite fermionic systems are described with a high degree of accuracy within a variational approach based on a combined coupled-cluster and particle-number-projected BCS ansatz. The flexibility of…

核理论 · 物理学 2021-06-02 V. V. Baran , J. Dukelsky

One-way measurement based quantum computations (1WQC) may describe unitary transformations, via a composition of CPTP maps which are not all unitary themselves. This motivates the following decision problems: Is it possible to determine…

量子物理 · 物理学 2009-10-22 Niel de Beaudrap

We formulate a parity-mixed coupled-cluster (PM-CC) approach for high-precision calculations of parity non-conserving amplitudes in mono-valent atoms. Compared to the conventional formalism which uses parity-proper (PP) one-electron…

原子物理 · 物理学 2022-02-16 H. B. Tran Tan , Di Xiao , A. Derevianko

We revise the unireps. of $U(2,2)$ describing conformal particles with continuous mass spectrum from a many-body perspective, which shows massive conformal particles as compounds of two correlated massless particles. The statistics of the…

数学物理 · 物理学 2014-09-22 M. Calixto , E. Perez-Romero

Despite their fundamental importance in dictating the quantum mechanical properties of a system, ground states of many-body local quantum Hamiltonians form a set of measure zero in the many-body Hilbert space. Hence determining whether a…

无序系统与神经网络 · 物理学 2021-06-23 Michael Matty , Yi Zhang , T. Senthil , Eun-Ah Kim

We present the quantum-selected configuration interaction-tailored coupled-cluster (QSCI-TCC) method, a hybrid quantum-classical scheme that tailors coupled-cluster (CC) theory with a quantum-selected configuration interaction (QSCI) wave…

化学物理 · 物理学 2025-06-23 Luca Erhart , Yuichiro Yoshida , Wataru Mizukami

We propose a general variational fermionic many-body wavefunction that generates an effective Hamiltonian in a quadratic form, which can then be exactly solved. The theory can be constructed within the density functional theory framework,…

强关联电子 · 物理学 2020-10-30 Xindong Wang , Xiao Chen , Liqin Ke , Hai-Ping Cheng , B. N. Harmon

Under an appropriate symmetric bulk bipartition in a one-dimensional symmetry protected topological phase with the Affleck-Kennedy-Lieb-Tasaki matrix product state wave function for the odd integer spin chains, a bulk critical entanglement…

强关联电子 · 物理学 2018-10-31 Zi-Qi Wang , Guo-Yi Zhu , Guang-Ming Zhang

We investigate the generation of quantum states and unitary operations that are ``random'' in certain respects. We show how to use such states to estimate the average fidelity, an important measure in the study of implementations of quantum…

量子物理 · 物理学 2007-05-23 Christoph Dankert

An entangled state is said to be $m$-uniform if the reduced density matrix of any $m$ qubits is maximally mixed. This is intimately linked to pure quantum error correction codes (QECCs), which allow not only to correct errors, but also to…

量子物理 · 物理学 2023-09-01 Sowrabh Sudevan , Daniel Azses , Emanuele G. Dalla Torre , Eran Sela , Sourin Das

Exact unitary transformations play a central role in the analysis and simulation of many-body quantum systems, yet the conditions under which they can be carried out exactly and efficiently remain incompletely understood. We show that exact…

量子物理 · 物理学 2025-12-09 Praveen Jayakumar , Tao Zeng , Artur F. Izmaylov