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We present a general framework for the efficient simulation of realistic fermionic systems with modern machine learning inspired representations of quantum many-body states, towards a universal tool for ab initio electronic structure. These…

Strongly Correlated Electrons · Physics 2023-05-16 Yannic Rath , George H. Booth

Simulations of supersymmetric models on the lattice with (spontaneously) broken supersymmetry suffer from a fermion sign problem related to the vanishing of the Witten index. We propose a novel approach which solves this problem in low…

High Energy Physics - Lattice · Physics 2011-04-04 David Baumgartner , Urs Wenger

Tensor network states, and in particular projected entangled pair states, play an important role in the description of strongly correlated quantum lattice systems. They do not only serve as variational states in numerical simulation…

Quantum Physics · Physics 2017-06-27 C. Wille , O. Buerschaper , J. Eisert

We show how techniques from machine learning and optimization can be used to find circuits of photonic quantum computers that perform a desired transformation between input and output states. In the simplest case of a single input state,…

We present a hybrid numerical approach to simulate quantum many body problems on two spatial dimensional quantum lattice models via the non-Abelian ab initio version of the density matrix renormalization group method on state-of-the-art…

Strongly Correlated Electrons · Physics 2024-06-05 Andor Menczer , Kornél Kapás , Miklós Antal Werner , Örs Legeza

Mean-field molecular dynamics based on path integrals is used to approximate canonical quantum observables for particle systems consisting of nuclei and electrons. A computational bottleneck is the sampling from the Gibbs density of the…

Numerical Analysis · Mathematics 2023-11-30 Xin Huang , Petr Plechac , Mattias Sandberg , Anders Szepessy

We propose a novel parametrization of the four-point vertex function in the one-loop one-particle irreducible renormalization group (RG) scheme for fermions. It is based on a decomposition of the effective two-fermion interaction into…

Strongly Correlated Electrons · Physics 2009-02-11 Christoph Husemann , Manfred Salmhofer

We study the ground states of lattice Hamiltonians that are invariant under permutations, in the limit where the number of lattice sites, N -> \infty. For spin systems, these are product states, a fact that follows directly from the quantum…

Quantum Physics · Physics 2013-09-24 Christina V. Kraus , Maciej Lewenstein , J. Ignacio Cirac

Simulating fermionic systems on a quantum computer requires a high-performing mapping of fermionic states to qubits. A characteristic of an efficient mapping is its ability to translate local fermionic interactions into local qubit…

Quantum Physics · Physics 2023-10-25 Mitchell Chiew , Sergii Strelchuk

Systems with long-range interactions display a short-time relaxation towards Quasi Stationary States (QSS) whose lifetime increases with the system size. In the paradigmatic Hamiltonian Mean-field Model (HMF) out-of-equilibrium phase…

Statistical Mechanics · Physics 2016-02-15 Gabriele Martelloni , Gianluca Martelloni , Pierre de Buyl , Duccio Fanelli

The Gaussian phase-space representation can be used to implement quantum dynamics for fermionic particles numerically. To improve numerical results, we explore the use of dynamical diffusion gauges in such implementations. This is achieved…

Mathematical Physics · Physics 2023-12-07 F Rousse , M Fasi , A Dmytryshyn , M Gulliksson , M Ogren

We propose an efficient numerical method, which combines the advantages of recently developed tensor-network based methods and standard trial wave functions, to study the ground state properties of quantum many-body systems. In this…

Strongly Correlated Electrons · Physics 2015-05-22 Olga Sikora , Hsueh-Wen Chang , Chung-Pin Chou , Frank Pollmann , Ying-Jer Kao

We investigate under which conditions a mixed state on a finite-dimensional multipartite quantum system may be the unique, globally stable fixed point of frustration-free semigroup dynamics subject to specified quasi-locality constraints.…

Quantum Physics · Physics 2016-03-28 Peter D. Johnson , Francesco Ticozzi , Lorenza Viola

We present a new variational method for investigating the ground state and out of equilibrium dynamics of quantum many-body bosonic and fermionic systems. Our approach is based on constructing variational wavefunctions which extend Gaussian…

Quantum Physics · Physics 2018-03-14 Tao Shi , Eugene Demler , J. Ignacio Cirac

A potential approach for demonstrating quantum advantage is using quantum computers to simulate fermionic systems. Quantum algorithms for fermionic system simulation usually involve the Hamiltonian evolution and measurements. However, in…

Quantum Physics · Physics 2025-05-14 Qing-Song Li , Jiaxuan Zhang , Huan-Yu Liu , Qingchun Wang , Yu-Chun Wu , Guo-Ping Guo

Mid-circuit measurements and measurement-controlled gates are supported by an increasing number of quantum hardware platforms and will become more relevant as an essential building block for quantum error correction. However, mid-circuit…

Quantum Physics · Physics 2025-02-27 Yanbin Chen , Innocenzo Fulginiti , Christian B. Mendl

Fermionic Gaussian states (FGSs) and the associated matchgate circuits play a central role in quantum information theory and condensed matter physics. Despite being possibly highly entangled, they can still be efficiently simulated on…

Quantum Physics · Physics 2026-03-09 Marc Langer , Raúl Morral-Yepes , Adam Gammon-Smith , Frank Pollmann , Barbara Kraus

Gradient-based optimization is a key ingredient of variational quantum algorithms, with applications ranging from quantum machine learning to quantum chemistry and simulation. The parameter-shift rule provides a hardware-friendly method for…

Quantum Physics · Physics 2025-10-08 Leonardo Banchi , Dominic Branford , Chetan Waghela

Achieving chemical accuracy in quantum simulations is often constrained by the measurement bottleneck: estimating operators requires a large number of shots, which remains costly even on fault-tolerant devices and is further exacerbated on…

Quantum Physics · Physics 2025-09-22 Isaac L. Huidobro-Meezs , Jun Dai , Rodrigo A. Vargas-Hernández

We report an N-Body approach to computing the Fock exchange matrix with and without permutational symmetry. The method achieves an O(N lg N) computational complexity through an embedded metric-query, allowing hierarchical application of…

Data Structures and Algorithms · Computer Science 2015-06-18 Matt Challacombe , Nicolas Bock
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