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Quantum simulation, the simulation of quantum processes on quantum computers, suggests a path forward for the efficient simulation of problems in condensed-matter physics, quantum chemistry, and materials science. While the majority of…

Quantum Physics · Physics 2022-10-03 Paul K. Faehrmann , Mark Steudtner , Richard Kueng , Maria Kieferova , Jens Eisert

We show how to apply the quantum adiabatic algorithm directly to the quantum computation of molecular properties. We describe a procedure to map electronic structure Hamiltonians to 2-local qubit Hamiltonians with a small set of physically…

Quantum Physics · Physics 2015-02-20 Ryan Babbush , Peter J. Love , Alán Aspuru-Guzik

QAssemble is a pure-Python package for the quantum many-body problem. It implements various functional approaches, such as tight-binding, Hartree-Fock, and GW approximations within a unified object-oriented architecture. Each physical…

Strongly Correlated Electrons · Physics 2026-04-27 Seongjun Mo , Dongming Li , Mancheon Han , Johan Jönsson , Byungkyun Kang , Hoonkyung Lee , Gabriel Kotliar , Sangkook Choi

The established approach of perturbative continuous unitary transformations (pCUTs) constructs effective quantum many-body Hamiltonians as perturbative series that conserve the number of one quasiparticle type. We extend the pCUT method to…

Strongly Correlated Electrons · Physics 2023-10-05 L. Lenke , A. Schellenberger , K. P. Schmidt

Recent works have shown that quantum computers can polynomially speed up certain SAT-solving algorithms even when the number of available qubits is significantly smaller than the number of variables. Here we generalise this approach. We…

Quantum Physics · Physics 2020-02-19 Yimin Ge , Vedran Dunjko

We show how a quantum computer may efficiently simulate a disordered Hamiltonian, by incorporating a pseudo-random number generator directly into the time evolution circuit. This technique is applied to quantum simulation of few-body…

Disordered Systems and Neural Networks · Physics 2020-03-25 Andrei Alexandru , Paulo F. Bedaque , Scott Lawrence

A model Hamiltonian that exhibits asymptotic freedom and a bound state, is used to show on example that similarity renormalization group procedure can be tuned to improve convergence of perturbative derivation of effective Hamiltonians,…

High Energy Physics - Theory · Physics 2009-11-07 Stanislaw D. Glazek , Jaroslaw Mlynik

We propose a new approach to utilize quantum computers for binary linear programming (BLP), which can be extended to general integer linear programs (ILP). Quantum optimization algorithms, hybrid or quantum-only, are currently general…

Data Structures and Algorithms · Computer Science 2026-02-13 András Czégel , Boglárka G. -Tóth

In quantum mechanics, the Schrieffer--Wolff (SW) transformation (also called quasi-degenerate perturbation theory) is known as an approximative method to reduce the dimension of the Hamiltonian. We present a geometric interpretation of the…

Quantum Physics · Physics 2026-04-01 Gergő Pintér , György Frank , Dániel Varjas , András Pályi

The goal of the present account is to review our efforts to obtain and apply a ``collective'' Hamiltonian for a few, approximately decoupled, adiabatic degrees of freedom, starting from a Hamiltonian system with more or many more degrees of…

Nuclear Theory · Physics 2009-09-25 G. Do Dang , A. Klein , N. R. Walet

Many-body fermionic quantum calculations performed on analog quantum computers are restricted by the presence of k-local terms, which represent interactions among more than two qubits. These originate from the fermion-to-qubit mapping…

This work develops a symplectic framework for quantum computing to be applied to classical Hamiltonian systems, exploiting the intrinsic geometric compatibility between unitary quantum evolution and symplectic phase-space dynamics in a…

Adiabatic elimination is a standard tool in quantum optics, which produces an effective Hamiltonian for a relevant subspace of states, incorporating effects of its coupling to states with much higher unperturbed energy. It shares with…

Quantum Physics · Physics 2015-09-30 Mikel Sanz , Enrique Solano , Íñigo L. Egusquiza

Manipulating Hamiltonians governing physical systems has found a broad range of applications, from quantum chemistry to semiconductor design. In this work, we provide a new way of manipulating Hamiltonians, by transforming their eigenvalues…

Quantum Physics · Physics 2025-04-30 Tatsuki Odake , Hlér Kristjánsson , Philip Taranto , Mio Murao

Simulating quantum many-body systems is a highly demanding task since the required resources grow exponentially with the dimension of the system. In the case of fermionic systems, this is even harder since nonlocal interactions emerge due…

The fidelity susceptibility serves as a universal probe for quantum phase transitions, offering an order-parameter-free metric that captures ground-state sensitivity to Hamiltonian perturbations and exhibits critical scaling. Classical…

Quantum Physics · Physics 2025-09-03 Yukun Zhang , Xiao Yuan

A hierarchy of semidefinite programming (SDP) relaxations approximates the global optimum of polynomial optimization problems of noncommuting variables. Generating the relaxation, however, is a computationally demanding task, and only…

Mathematical Software · Computer Science 2015-06-15 Peter Wittek

The quantum circuit model is the de-facto way of designing quantum algorithms. Yet any level of abstraction away from the underlying hardware incurs overhead. In the era of near-term, noisy, intermediate-scale quantum (NISQ) hardware with…

Quantum Physics · Physics 2021-08-27 Laura Clinton , Johannes Bausch , Toby Cubitt

We propose an effective and flexible scheme for reverse engineering of a Hamiltonian by designing the evolution operators to eliminate the terms of Hamiltonian which are hard to be realized in practice. Different from transitionless quantum…

Quantum Physics · Physics 2016-08-15 Yi-Hao Kang , Ye-Hong Chen , Qi-Cheng Wu , Bi-Hua Huang , Yan Xia , Jie Song

An approximate diagonalization method is proposed that combines exact diagonalization and perturbation expansion to calculate low energy eigenvalues and eigenfunctions of a Hamiltonian. The method involves deriving an effective Hamiltonian…

Quantum Physics · Physics 2013-05-30 Mohammad H. Amin , Anatly Yu. Smirnov , Neil G. Dickson , Marshal Drew-Brook