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arXiv:2104.00728 · Physical Review Letters

Fixed Depth Hamiltonian Simulation via Cartan Decomposition

Efekan Kökcü, Thomas Steckmann, Yan Wang, James K. Freericks, Eugene Dumitrescu, Alexander F. Kemper

Published Aug 9, 2022• 61 citations
arXivHTMLPDF

Abstract

Simulating quantum dynamics on classical computers is challenging for large systems due to the significant memory requirements. Simulation on quantum computers is a promising alternative, but fully optimizing quantum circuits to minimize limited quantum resources remains an open problem. We tackle this problem by presenting a constructive algorithm, based on Cartan decomposition of the Lie algebra generated by the Hamiltonian, which generates quantum circuits with time-independent depth. We highlight our algorithm for special classes of models, including Anderson localization in one-dimensional transverse field XY model, where O(n^{2})-gate circuits naturally emerge. Compared to product formulas with significantly larger gate counts, our algorithm drastically improves simulation precision. In addition to providing exact circuits for a broad set of spin and fermionic models, our algorithm provides broad analytic and numerical insight into optimal Hamiltonian simulations.

DOI
10.1103/physrevlett.129.070501

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Simulating quantum dynamics on classical computers is challenging for large systems due to the significant memory requirements. Simulation on quantum computers is a promising alternative, but fully optimizing quantum circuits to minimize limited quantum resources remains an open problem. We tackle this problem by presenting a constructive algorithm, based on Cartan decomposition of the Lie algebra generated by the Hamiltonian, which generates quantum circuits with time-independent depth. We highlight our algorithm for special classes of models, including Anderson localization in one-dimensional transverse field XY model, where O(n^{2})-gate circuits naturally emerge. Compared to product formulas with significantly larger gate counts, our algorithm drastically improves simulation precision. In addition to providing exact circuits for a broad set of spin and fermionic models, our algorithm provides broad analytic and numerical insight into optimal Hamiltonian simulations.
A critical step in developing circuits for quantum simulation is to synthesize a desired unitary operator using the circuit building blocks. Studying unitaries and their generators from the Lie algebraic perspective has given rise to several algorithms for synthesis based on a Cartan decomposition of the dynamical Lie algebra. For unitaries of the form e−itHe^{-itH}e−itH, such as time-independent Hamiltonian simulation, the resulting circuits have depth that does not depend on simulation time ttt. However, finding such circuits has a large classical overhead in the cost function evaluation and the high dimensional optimization problem. In this work, by further partitioning the dynamical Lie algebra, we break down the optimization problem into smaller independent subproblems. Moreover, the resulting algebraic structure allows us to easily shift the evaluation of the cost function to the quantum computer, further cutting the classical overhead of the algorithm. As an application of the new hybrid algorithm, we synthesize the time evolution unitary for the 4-site transverse field Ising model on several IBM devices and Quantinuum's H1-1 quantum computer.
Quantum algorithms usually are described via quantum circuits representable as unitary operators. Synthesizing the unitary operators described mathematically in terms of the unitary operators recognizable as quantum circuits is essential. One such a challenge lies in the Hamiltonian simulation problem, where the matrix exponential of a large-scale skew-Hermitian matrix is to be computed. Most current techniques are prone to approximation errors, whereas the parametrization of the underlying Hamiltonian via the Cartan decomposition is more promising. To prepare for such a simulation, this work proposes to tackle the Cartan decomposition by means of the Lax dynamics. The advantages include not only that it is numerically feasible with no matrices involved, but also that this approach offers a genuine unitary synthesis within the integration errors. This work contributes to the theoretic and algorithmic foundations in three aspects: exploiting the quaternary representation of Hamiltonian subalgebras; describing a common mechanism for deriving the Lax dynamics; and providing a mathematical theory of convergence.
A fundamental challenge in quantum simulation is approximating the time-evolution operator U(t)=e−iHtU(t)=e^{-i\mathcal{H}t}U(t)=e−iHt generated by a large sum of typically non-commuting Hamiltonians using resource-efficient circuits compatible with near-term devices. We present a refinement of fixed-depth Lie-theoretic simulation that incorporates second-order Zassenhaus commutator corrections into a Cartan/KAK decomposition template. The resulting approximation retains constant circuit depth while achieving local error O(t3)\mathcal{O}(t^3)O(t3) in operator norm under standard boundedness assumptions, and it substantially reduces gate counts relative to first-order product formulas when time is large and depth is constrained. The method leverages closure of Pauli commutators inside Pauli-generated Lie algebras, enabling symbolic commutator evaluation and avoiding explicit matrix exponentiation in classical preprocessing. This yields a structured pathway to compile lattice and chemistry-inspired Hamiltonians with locality constraints into fixed-depth circuits suitable for noisy intermediate-scale quantum hardware.
Understanding the dynamics of interacting quantum systems is a central goal of quantum simulation. For geometrically local Hamiltonians, locality suggests that digital simulation should retain much of the parallelism of the underlying dynamics. For a target accuracy εεε, we construct a nearest-neighbor quantum circuit that simulates the dynamics of an nnn-qubit, time-independent, finite-range Hamiltonian with normalized local interaction strength on a fixed-dimensional lattice for time T≥1T\ge1T≥1, with circuit depth O(Tlog⁡(nT/ε))O(T\log(nT/ε))O(Tlog(nT/ε)) and gate count O(nTlog⁡(nT/ε))O(nT\log(nT/ε))O(nTlog(nT/ε)). This reduces the polylogarithmic overhead of Haah, Hastings, Kothari, and Low to a single logarithm. On logarithmic-scale blocks from the Lieb--Robinson decomposition, a shallow but highly accurate implementation is essential for reducing the circuit depth. Our key observation is that spatial localization also controls the cost of high precision. In each block, the error of a constant-order product formula is compensated for by a correction, yielding exponential accuracy. The correction can be implemented with depth proportional to the block diameter, introducing no additional asymptotic depth scale beyond that required by spatial localization. Furthermore, we prove an unconditional circuit-depth lower bound for uniform XXZ Hamiltonians: at fixed evolution time TTT in the stated regime and sufficiently small fixed error εεε, any nearest-neighbor quantum circuit simulating these dynamics requires depth Ω(log⁡n/log⁡log⁡n)Ω(\log n/\log\log n)Ω(logn/loglogn). This matches our O(log⁡n)O(\log n)O(logn) upper bound up to a doubly logarithmic factor, establishing near-optimal circuit depth for lattice Hamiltonian simulation in this regime. Together, these results clarify the role of locality and precision in determining the circuit complexity of quantum dynamics and suggest broader principles for spatially constrained quantum computation.
Quantum dynamics simulations (QDSs) are one of the most highly anticipated applications of quantum computing. Quantum circuit depth for implementing Hamiltonian simulation algorithms is commonly time dependent so that long time dynamics simulations become impratical on near-term quantum processors. The Hamiltonian simulation algorithm based on Cartan decomposition (CD) provides an appealing scheme for QDSs with fixed-depth circuits while limited to time-independent case. In this work, we generalize this CD-based Hamiltonian simulation algorithm for studying time-dependent systems by combining it with variational Hamiltonian simulation. The time-dependent and time-independent parts of the Hamiltonian are treated with the variational approach and the CD-based Hamiltonian simulation algorithms, respectively. As such, only fixed-depth quantum circuits are required in this hybrid Hamiltonian simulation algorithm while still maintaining high accuracy. We apply this new algorithm to study the response of spin and molecular systems to δδδ-kick electric fields and obtain accurate spectra for these excitation processes.
Hamiltonian simulation is one of the most anticipated applications of quantum computing. Quantum circuit depth for implementing Hamiltonian simulation is commonly time dependent using Trotter-Suzuki product formulas so that long time quantum dynamic simulations (QDSs) become impratical for near-term quantum processors. Hamiltonian simulation based on Cartan decomposition (CD) provides an appealing scheme for QDSs with fixed-depth circuits, while it is limited to a time-independent Hamiltonian. In this work, we generalize this CD-based Hamiltonian simulation algorithm for studying time-dependent systems by combining it with variational quantum algorithms. The time-dependent and time-independent parts of the Hamiltonian are treated by using variational and CD-based Hamiltonian simulation algorithms, respectively. As such, this hybrid Hamiltonian simulation requires only fixed-depth quantum circuits to handle time-dependent cases while maintaining a high accuracy. We apply this new algorithm to study the response of spin and molecular systems to δ-kick electric fields and obtain accurate spectra for these excitation processes.