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arXiv:1606.00208 · Physical Review A

Quantum gates and architecture for the quantum simulation of the Fermi-Hubbard model

Pierre-Luc Dallaire-Demers, Frank K. Wilhelm

Published Dec 5, 2016• 34 citations
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Abstract

Quantum computers are the ideal platform for quantum simulations. Given enough coherent operations and qubits, such machines can be leveraged to simulate strongly correlated materials, where intricate quantum effects give rise to counterintuitive macroscopic phenomena such as high-temperature superconductivity. In this paper, we provide a gate decomposition and an architecture for a quantum simulator used to simulate the Fermi-Hubbard model in a hybrid variational quantum-classical algorithm. We propose a simple planar implementation-independent layout of qubits that can also be used to simulate more general fermionic systems. By working through a concrete application, we show the gate decomposition used to simulate the Hamiltonian of a cluster of the Fermi-Hubbard model. We briefly analyze the Trotter-Suzuki errors and estimate the scaling properties of the algorithm for more complex applications.

DOI
10.1103/physreva.94.062304

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Quantum computers are the ideal platform for quantum simulations. Given enough coherent operations and qubits, such machines can be leveraged to simulate strongly correlated materials, where intricate quantum effects give rise to counterintuitive macroscopic phenomena such as high-temperature superconductivity. In this paper, we provide a gate decomposition and an architecture for a quantum simulator used to simulate the Fermi-Hubbard model in a hybrid variational quantum-classical algorithm. We propose a simple planar implementation-independent layout of qubits that can also be used to simulate more general fermionic systems. By working through a concrete application, we show the gate decomposition used to simulate the Hamiltonian of a cluster of the Fermi-Hubbard model. We briefly analyze the Trotter-Suzuki errors and estimate the scaling properties of the algorithm for more complex applications.
The Fermi-Hubbard model, a fundamental framework for studying strongly correlated phenomena could significantly benefit from quantum simulations when exploring non-trivial settings. However, simulating this problem requires twice as many qubits as the physical sites, in addition to complicated on-chip connectivities and swap gates required to simulate the physical interactions. In this work, we introduce a novel quantum simulation approach utilizing qudits to overcome such complexities. Leveraging on the symmetries of the Fermi-Hubbard model and their intrinsic relation to Clifford algebras, we first demonstrate a Qudit Fermionic Mapping (QFM) that reduces the encoding cost associated with the qubit-based approach. We then describe the unitary evolution of the mapped Hamiltonian by interpreting the resulting Majorana operators in terms of physical single- and two-qudit gates. While the QFM can be used for any quantum hardware with four accessible energy levels, we demonstrate the specific reduction in overhead resulting from utilizing the native Controlled-SUM gate (equivalent to qubit CNOT) for a fixed-frequency ququart transmon. We further transpile the resulting two transmon-qudit gates by demonstrating a qudit operator Schmidt decomposition using the Controlled-SUM gate. Finally, we demonstrate the efficacy of our proposal by numerical simulation of local observables such as the filling factor and Green's function for various Trotter steps. The compatibility of our approach with different qudit platforms paves the path for achieving quantum advantage in simulating non-trivial quantum many-body systems.
Strongly correlated quantum systems give rise to many exotic physical phenomena, including high-temperature superconductivity. Simulating these systems on quantum computers may avoid the prohibitively high computational cost incurred in classical approaches. However, systematic errors and decoherence effects presented in current quantum devices make it difficult to achieve this. Here, we simulate the dynamics of the one-dimensional Fermi-Hubbard model using 16 qubits on a digital superconducting quantum processor. We observe separations in the spreading velocities of charge and spin densities in the highly excited regime, a regime that is beyond the conventional quasiparticle picture. To minimize systematic errors, we introduce an accurate gate calibration procedure that is fast enough to capture temporal drifts of the gate parameters. We also employ a sequence of error-mitigation techniques to reduce decoherence effects and residual systematic errors. These procedures allow us to simulate the time evolution of the model faithfully despite having over 600 two-qubit gates in our circuits. Our experiment charts a path to practical quantum simulation of strongly correlated phenomena using available quantum devices.
The Fermi–Hubbard model is a fundamental model in condensed matter physics that describes strongly correlated electrons. On the other hand, quantum computers are emerging as powerful tools for exploring the complex dynamics of these quantum many-body systems. In this work, we demonstrate the quantum simulation of the one-dimensional Fermi–Hubbard model using IBM's superconducting quantum computers, employing over 100 qubits. We introduce a first-order Trotterization scheme and extend it to an optimized second-order Trotterization for the time evolution in the Fermi–Hubbard model, specifically tailored for the limited qubit connectivity of quantum architectures, such as IBM's platforms. Notably, both Trotterization approaches are scalable and maintain a constant circuit depth at each Trotter step, regardless of the qubit count, enabling us to precisely investigate the relaxation dynamics in the Fermi–Hubbard model by measuring the expectation value of the Néel observable (staggered magnetization) for time-evolved quantum states. Finally, our successful measurement of expectation values in such large-scale quantum many-body systems, especially at longer time scales with larger entanglement, highlights the quantum utility of superconducting quantum platforms over conventional classical approximation methods.
Many phenomena of strongly correlated materials are encapsulated in the Fermi-Hubbard model whose thermodynamic properties can be computed from its grand-canonical potential. In general, there is no closed-form expression of the grand-canonical potential for lattices of more than one spatial dimension, but solutions can be numerically approximated using cluster methods. To model long-range effects such as order parameters, a powerful method to compute the cluster's Green's function consists of finding its self-energy through a variational principle. This allows the possibility of studying various phase transitions at finite temperature in the Fermi-Hubbard model. However, a classical cluster solver quickly hits an exponential wall in the memory (or computation time) required to store the computation variables. Here it is shown theoretically that the cluster solver can be mapped to a subroutine on a quantum computer whose quantum memory usage scales linearly with the number of orbitals in the simulated cluster and the number of measurements scales quadratically. A quantum computer with a few tens of qubits could therefore simulate the thermodynamic properties of complex fermionic lattices inaccessible to classical supercomputers.
In the framework of the hybrid quantum-classical variational cluster approach to strongly correlated electron systems one of the goals of a quantum subroutine is to find single-particle correlation functions of lattice fermions in polynomial time. Previous works suggested to use variants of the Hadamard test for this purpose, which requires an implementation of controlled single-particle fermionic operators. However, for a number of locality-preserving mappings to encode fermions into qubits, a direct construction of such operators is not possible. In this work, we propose a quantum algorithm that uses an analog of the Kubo formula adapted to a quantum circuit simulating the Hubbard model. It allows to access the Green's function of a cluster directly using only bilinears of fermionic operators and circumvents the usage of the Hadamard test. We test our algorithm in practice by using open-access simulators of noisy IBM superconducting chips.
Among the most compelling targets for quantum simulation are strongly correlated phases and electronic-structure problems, where interactions organize electrons into collective states and produce intricate low-temperature phase diagrams. Cuprate superconductors are a canonical example: at low doping, superconductivity emerges from a metallic regime that exhibits a pseudogap above the critical temperature. Ultracold atoms in optical lattices provide a well-controlled, tunable setting to probe the microscopic mechanisms behind this behavior and, in fermion-native architectures, to implement electronic structure dynamics directly. This thesis demonstrates both large scale systematic analog quantum simulations in the most interesting regime of doped antiferromagnets and elementary high-fidelity gates as the basis for a digital or hybrid fermionic quantum processors in an optical lattice. Working with ultracold Lithium-6 in a two–dimensional optical superlattice, we first map the parameter space of the Fermi–Hubbard model over a wide range of temperatures and dopings. More than 40000 single-site spin- and density-resolved snapshots, spanning over a dense grid of doping levels and temperatures in a numerically challenging parameter space, reveal antiferromagnetic correlations extending across the system size and into the pseudogap regime. Temperatures down to T/t=0.2 are realized, determined by benchmarking the data to state-of-the-art numerical methods. By evaluating spin–charge correlators up to fifth order, we experimentally uncover a universal scaling behavior across the pseudogap crossover, governed by a single, doping-dependent temperature scale. These findings provide the first microscopic evidence of universal scaling in multi-point correlators and establish stringent benchmarks for future theoretical developments. On the same apparatus, we demonstrate that the controlled motion of fermions in double wells enables high-fidelity entanglement. Double-well potentials are used to engineer coherent pair-tunnelling and spin-exchange interactions that act as native SWAP^α operations. We demonstrate the collisional gate fidelities up to 99.8% and Bell-state lifetimes exceeding ten seconds, limited mainly by residual inhomogeneities in the optical potential. A composite pulse sequence isolates the pair-exchange channel, realizing the elementary building block required for fermionic quantum-chemistry algorithms. With the addition of site-selective addressing, our results mark a key step towards a fully digital, scalable fermionic quantum computer based on the controlled motion and entanglement of fermionic neutral atoms. The work establishes a hybrid analog-digital architecture: analog evolution under the Hubbard Hamiltonian yields thermodynamic states whose magnetic properties match and extend theoretical benchmarks, while digital collisional gates provide building blocks for error-corrected quantum computation and complex state preparation.