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arXiv:2307.06580 · Quantum Science and Technology

Quantum simulation of boson-related Hamiltonians: techniques, effective Hamiltonian construction, and error analysis

Bo Peng, Yuan Su, Daniel Claudino, Karol Kowalski, Guang Hao Low, Martin Roetteler

Published Mar 11, 2025• 10 citations
arXivHTMLPDF

Abstract

Abstract Elementary quantum mechanics proposes that a closed physical system consistently evolves in a reversible manner. However, control and readout necessitate the coupling of the quantum system to the external environment, subjecting it to relaxation and decoherence. Consequently, system-environment interactions are indispensable for simulating physically significant theories. A broad spectrum of physical systems in condensed-matter and high-energy physics, vibrational spectroscopy, and circuit and cavity QED necessitates the incorporation of bosonic degrees of freedom, such as phonons, photons, and gluons, into optimized fermion algorithms for near-future quantum simulations. In particular, when a quantum system is surrounded by an external environment, its basic physics can usually be simplified to a spin or fermionic system interacting with bosonic modes. Nevertheless, troublesome factors such as the magnitude of the bosonic degrees of freedom typically complicate the direct quantum simulation of these interacting models, necessitating the consideration of a comprehensive plan. This strategy should specifically include a suitable fermion/boson-to-qubit mapping scheme to encode sufficiently large yet manageable bosonic modes, and a method for truncating and/or downfolding the Hamiltonian to the defined subspace for performing an approximate but highly accurate simulation, guided by rigorous error analysis. In this pedagogical tutorial review, we aim to provide such an exhaustive strategy, focusing on encoding and simulating certain bosonic-related model Hamiltonians, inclusive of their static properties and time evolutions. Specifically, we emphasize two aspects: (1) the discussion of recently developed quantum algorithms for these interacting models and the construction of effective Hamiltonians, and (2) a detailed analysis regarding a tightened error bound for truncating the bosonic modes for a class of fermion-boson interacting Hamiltonians.

DOI
10.1088/2058-9565/adbf42

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Abstract Elementary quantum mechanics proposes that a closed physical system consistently evolves in a reversible manner. However, control and readout necessitate the coupling of the quantum system to the external environment, subjecting it to relaxation and decoherence. Consequently, system-environment interactions are indispensable for simulating physically significant theories. A broad spectrum of physical systems in condensed-matter and high-energy physics, vibrational spectroscopy, and circuit and cavity QED necessitates the incorporation of bosonic degrees of freedom, such as phonons, photons, and gluons, into optimized fermion algorithms for near-future quantum simulations. In particular, when a quantum system is surrounded by an external environment, its basic physics can usually be simplified to a spin or fermionic system interacting with bosonic modes. Nevertheless, troublesome factors such as the magnitude of the bosonic degrees of freedom typically complicate the direct quantum simulation of these interacting models, necessitating the consideration of a comprehensive plan. This strategy should specifically include a suitable fermion/boson-to-qubit mapping scheme to encode sufficiently large yet manageable bosonic modes, and a method for truncating and/or downfolding the Hamiltonian to the defined subspace for performing an approximate but highly accurate simulation, guided by rigorous error analysis. In this pedagogical tutorial review, we aim to provide such an exhaustive strategy, focusing on encoding and simulating certain bosonic-related model Hamiltonians, inclusive of their static properties and time evolutions. Specifically, we emphasize two aspects: (1) the discussion of recently developed quantum algorithms for these interacting models and the construction of effective Hamiltonians, and (2) a detailed analysis regarding a tightened error bound for truncating the bosonic modes for a class of fermion-boson interacting Hamiltonians.
Quantum simulation involves using a quantum system to study another quantum system. The proposal to simulate quantum physics using quantum mechanical devices, as outlined by Richard Feynman in 1982, stems from classical computers' challenges in simulating quantum systems. The pursuit of simulating complex quantum systems has led to the intersection of quantum mechanics and quantum computing. This offers new opportunities to understand and manipulate the quantum world. Central to describing quantum dynamics is the Hamiltonian operator H^\hat{H}H^, which governs the time evolution of physical systems and serves as the mathematical foundation for quantum simulations. This thesis explores the methodologies and advancements in simulating Hamiltonian operators on quantum computers, focusing on decomposing these operators into quantum gates and the efficiency gains over classical computational approaches. Initially, the thesis explains the fundamental theory and basics of quantum computing. Further it dives into the foundations of the Hamiltonian operator within quantum mechanics, highlighting its role in describing the dynamics of quantum systems. The complexity and high-dimensional nature of Hamiltonian matrices necessitate using quantum computers to simulate quantum phenomena accurately and efficiently. The process of simulating the Hamiltonian operator on a quantum computer involves a detailed examination of the strategies for decomposing the operator into a sequence of quantum gates. This decomposition is crucial for translating the abstract mathematical description of quantum systems into the physical operations of a quantum computer. By utilizing the principles of quantum mechanics, such as superposition and entanglement, quantum gates manipulate qubits to mimic the evolution of quantum states as the Hamiltonian operator dictates. Latter portions of the thesis are dedicated to comparing the efficiency of quantum simulations against traditional classical simulations and inspecting efficient quantum simulations. Quantum computers offer a polynomial or an exponential speedup for certain classes of problems, such as those involving highly entangled quantum states or requiring the simulation of complex quantum dynamics. This advantage is due to the quantum computer's ability to naturally represent and process quantum information - a task for which classical computers require exponential resources as the system size increases. The efficiency of simulating the Hamiltonian operator on a quantum computer is further enhanced through optimization techniques and algorithmic improvements. These include error mitigation strategies and the development of quantum algorithms tailored to specific types of Hamiltonian operators. The thesis presents a comprehensive analysis of these methods, demonstrating how they make quantum simulations more practical and accessible for scientific research and technological development. In conclusion this thesis is a literature review that examines the transformative potential of quantum simulations. By efficiently simulating the Hamiltonian operator on quantum computers researchers can explore quantum phenomena with precision, paving the way for breakthroughs in quantum physics, materials science, and beyond. The advancements in quantum computing technology and algorithmic approaches discussed here highlight the current capabilities and future explorations in the quantum realm.
Non-Markovian effects are important in modeling the behavior of open quantum systems arising in solid-state physics, quantum optics as well as in study of biological and chemical systems. A common approach to the analysis of such systems is to approximate the non-Markovian environment by discrete bosonic modes thus mapping it to a Lindbladian or Hamiltonian simulation problem. While systematic constructions of such modes have been proposed in previous works [D. Tamascelli et al, PRL (2012), A. W. Chin et al, J. of Math. Phys (2010)], the resulting approximation lacks rigorous convergence guarantees. In this paper, we initiate a rigorous study of the convergence properties of these methods. We show that under some physically motivated assumptions on the system-environment interaction, the finite-time dynamics of the non-Markovian open quantum system computed with a sufficiently large number of modes is guaranteed to converge to the true result. Furthermore, we show that, for most physically interesting models of non-Markovian environments, the approximation error falls off polynomially with the number of modes. Our results lend rigor to numerical methods used for approximating non-Markovian quantum dynamics and allow for a quantitative assessment of classical as well as quantum algorithms in simulating non-Markovian quantum systems.
We introduce a method for representing the low-energy subspace of a bosonic field theory on the qubit space of digital quantum computers. This discretization leads to an exponentially precise description of the subspace of the continuous theory thanks to the Nyquist-Shannon sampling theorem. The method makes the implementation of quantum algorithms for purely bosonic systems as well as fermion-boson interacting systems feasible. We present algorithmic circuits for computing the time evolution of these systems. The complexity of the algorithms scales polynomially with the system size. The algorithm is a natural extension of the existing quantum algorithms for simulating fermion systems in quantum chemistry and condensed-matter physics to systems involving bosons and fermion-boson interactions and has a broad variety of potential applications in particle physics, condensed matter, etc. Due to the relatively small amount of additional resources required by the inclusion of bosons in our algorithm, the simulation of electron-phonon and similar systems can be placed in the same near-future reach as the simulation of interacting electron systems. We benchmark our algorithm by implementing it for a two-site Holstein polaron problem on an Atos Quantum Learning Machine quantum simulator. The polaron quantum simulations are in excellent agreement with the results obtained by exact diagonalization.
Over the last decade, quantum simulation and computation has progressed from a purely scientific testbed of quantum mechanics to a mature field that is starting to offer new insights into materials, quantum effects, and algorithms that are intractable with even the most state-of-the-art classical computation. Simulating certain quantum Hamiltonians that are theorized to be at the heart of high-Tc superconductivity, topological quantum systems such as the fractional quantum Hall effect or fundamental questions of thermalization quickly exceed the available memory of even the most advanced supercomputers – and in fact all memory in the world – due to the exponential growth of the Hilbert space with system size. As postulated by Feynman himself, the computational system best suited for solving quantum problems is to use a quantum system itself, as it can intrinsically represent the entanglement that is the key resource making quantum computing challenging but also promising. Apart from simulating problems in physics and chemistry, there is also tremendous excitement for quantum computers to provide speedups for general algorithms in optimization at a rate that is exponentially faster than existing classical programming. So far only a small class of algorithms has been actually proven to provide such a speedup, most prominently Shor's algorithm which can factor large prime numbers, and several other search and oracle algorithms. In the last two decades, many experiments using ultracold atoms, ions, or superconducting circuits have focused on analog quantum simulation. Here, a model Hamiltonian that is believed to capture all the relevant physics of the system of study is experimentally realized using different building blocks and interactions but replicating condensed matter effects at an increased scale. This has led to a number of bespoke experiments such as BEC/Fermigass machines, quantum gas microscopes and more exotic setups that are purpose built to study a particular effect. More recently, there has been a shift to develop more universal simulation platforms and optical tweezer arrays have emerged as a leading solution due to their high degree of reconfigurability. Through tremendous improvements in the degree of control and measurement of single qubits, error correction has become a viable route to build a true universal digital quantum computer. Even as we transition into the digital age of quantum simulation, certain classes of problems with additional physics constraints such as Fermionic statistics, gauge fields and lattice gauge theories still incur too large of an overhead to be encoded on these digital simulators. In this thesis, we use a highly degenerate twisted cavity to simulate the effect of a magnetic field on a two-dimensional system of interacting photons to enable realization of states of the quantum Hall effect. We design, build, and commission a new lens based cavity apparatus realizing a lowest Landau level for a mesoscopic number of modes. We demonstrate the integration of highly excited Rydberg atoms to mediate strong interactions and demonstrate photon blockade as well as mean field interactions. As a second application of cavities to quantum information leveraging our newfound comfort with intra-cavity optics, and experience with aberration modeling in resonators, we demonstrate a new class of small waist optical resonators enabled by lens-based cavities and then apply our understanding of optical aberrations in cavities to the development of a new class of cavity array. This Cavity Array Microscope (CAM) realizes a large number of cavities (up to currently 600) using only a fixed number of free space optics and is both scalable with constant overhead as well as compatible with Rydberg atoms. This platform provides a route to highly parallel quantum repeater operation or entanglement generation between atom arrays in the future.
Open quantum systems have drawn attention over decades due to its applicability in the foundation of theoretical physics, e.g. statistical mechanics, quantum mechanics and condensed matter physics. The dynamics of open quantum systems has been described as separate entities from their surrounding environment that consists of a very large number of modes, somehow coupled to the mode of the system. Even though the exact solution of the dynamical behavior of the system is impossible to calculate, we obtain a tentative solution using the crucial Markov approximation. The input-output formalism of the quantum Langevin equation (QLE) has been considered as a useful tool which provides a semi-classical description of the dynamics of the system, whereas the master equation provides a complete picture of the dynamics of the system expressed in terms of density matrix. While studying the dynamics of nonlinear system/environment coupling using QLE, we see, for a small value of external field, that the steady state system field does not change much from the steady state field obtained in the absence of nonlinear dissipation. However, in a case where a stronger external field is applied, we see that the deviation becomes substantial from the solution of linear system. We also see that the nonlinear coupling introduces significant difference in the cavity fluctuation spectrum. The description, therefore, provides a potential explanation of parametric effects in terms of nonlinear dissipation phenomena associated with the nonlinear coupling. Even though the theories developed in the context of open quantum systems have proven to be powerful tools, they do not provide a satisfactory platform to be implemented on non-linear Hamiltonians. We often approximate it by linearizing over nonlinear steady state field amplitude, and therefore, the interesting effects are often overlooked. The limitation of the analytics provokes us to simulate open quantum dynamics numerically. The numerical method consists of transformation of the environmental degrees of freedom to a one-dimensional many-body chain, and the computational technique includes numerical diagonalization and renormalization process. The time-adaptive density matrix renormalisation group (t-DMRG) is known as one of the most powerful techniques for the simulation of strongly-correlated many-body quantum systems. In this thesis, along with the theoretical modeling, we implement DMRG numerical scheme for the simulation of canonical S/B model by mapping it to one-dimensional harmonic chain with nearest neighbor interactions, and use the method to investigate the dynamics of the free dissipative system. The thermalization of open quantum systems is also studied by generating minimally entangled typical thermal states (METTS) through imaginary time evolution, and real-time evolving an empty system in the presence of the thermal bath. Further, we simulate coherently driven free dissipative Kerr nonlinear system numerically using Euler's method by solving Heisenberg equation of motion and t-DMRG algorithm, and demonstrate how the numerical results are analogous to classical bistability. By comparing with analytics, we see that the DMRG numerics is analogous to the quantum-mechanical exact solution obtained by mapping the equation of motion of the density matrix of the system to a Fokker-Plank equation. The comparison between two different numerical techniques shows that the semi-classical Euler's method determines the dynamics of the system field of one among two coherent branches, whereas DMRG numerics gives the superposition of both of them. Hence, DMRG-determined time dynamics undergoes generating non-classical states. Our approach of dealing with nonlinearity represents an important contribution in the developments of technique to study the dynamical and steady-state behavior of open quantum systems, which is a fundamental aspect of quantum physics.
Universal digital quantum computers are able to approximate any Hamiltonian evolution as a digital quantum circuit consisting of discrete time steps. Strongly interacting physics models, for example in high-energy physics or materials science, make this a challenging task for near-term devices as they place a high demand on the quantum resources required [1]. One alternative is analog quantum simulation where the native evolution of a quantum system can be tailored to mimic that of the model of interest. While more efficient at specific problems, there are limits on the types of evolution available and on the observables that can be measured. In this conference paper we present first results towards unifying these two concepts in a trapped-ion experiment. Trapped atomic ions are one of the most advanced experimental platforms for both analog quantum simulation and digital quantum computing. Typically, the internal spin degrees of freedom are used qubits or for the simulation of spin models. The harmonic oscillator modes given by the motion of the ions in the trap are only employed transiently to create quantum gates or spin-spin interactions. However, these motional modes constitute a large Hilbert space themselves and present a bosonic degree of freedom, which is costly to model with qubits. Many systems of interest, for example Lattice gauge theories, require both spin and boson degrees of freedom. It was recently shown that they can be encoded more efficiently using the harmonic oscillator modes directly [2].