Abstract We numerically emulate noisy intermediate-scale quantum (NISQ) devices and determine the minimal hardware requirements for two-site hybrid quantum–classical dynamical mean-field theory (DMFT). We develop a circuit recompilation algorithm which significantly reduces the number of quantum gates of the DMFT algorithm and find that the quantum–classical algorithm converges if the two-qubit gate fidelities are larger than 99%. The converged results agree with the exact solution within 10%, and perfect agreement within noise-induced error margins can be obtained for two-qubit gate fidelities exceeding 99.9%. By comparison, the quantum–classical algorithm without circuit recompilation requires a two-qubit gate fidelity of at least 99.999% to achieve perfect agreement with the exact solution. We thus find quantum–classical DMFT calculations can be run on the next generation of NISQ devices if combined with the recompilation techniques developed in this work.
Abstract We numerically emulate noisy intermediate-scale quantum (NISQ) devices and determine the minimal hardware requirements for two-site hybrid quantum–classical dynamical mean-field theory (DMFT). We develop a circuit recompilation algorithm which significantly reduces the number of quantum gates of the DMFT algorithm and find that the quantum–classical algorithm converges if the two-qubit gate fidelities are larger than 99%. The converged results agree with the exact solution within 10%, and perfect agreement within noise-induced error margins can be obtained for two-qubit gate fidelities exceeding 99.9%. By comparison, the quantum–classical algorithm without circuit recompilation requires a two-qubit gate fidelity of at least 99.999% to achieve perfect agreement with the exact solution. We thus find quantum–classical DMFT calculations can be run on the next generation of NISQ devices if combined with the recompilation techniques developed in this work.
Abstract We report on a quantum–classical simulation of the single-band Hubbard model using two-site dynamical mean-field theory (DMFT). Our approach uses IBM’s superconducting qubit chip to compute the zero-temperature impurity Green’s function in the time domain and a classical computer to fit the measured Green’s functions and extract their frequency domain parameters. We find that the quantum circuit synthesis (Trotter) and hardware errors lead to incorrect frequency estimates, and subsequently to an inaccurate quasiparticle weight when calculated from the frequency derivative of the self-energy. These errors produce incorrect hybridization parameters that prevent the DMFT algorithm from converging to the correct self-consistent solution. To avoid this pitfall, we compute the quasiparticle weight by integrating the quasiparticle peaks in the spectral function. This method is much less sensitive to Trotter errors and allows the algorithm to converge to self-consistency for a half-filled Mott insulating system after applying quantum error mitigation techniques to the quantum simulation data.
The developments of quantum computing algorithms and experiments for atomic scale simulations have largely focused on quantum chemistry for molecules, while their application in condensed matter systems is scarcely explored. Here we present a quantum algorithm to perform dynamical mean field theory (DMFT) calculations for condensed matter systems on currently available quantum computers, and demonstrate it on two quantum hardware platforms. DMFT is required to properly describe the large class of materials with strongly correlated electrons. The computationally challenging part arises from solving the effective problem of an interacting impurity coupled to a bath, which scales exponentially with system size on conventional computers. An exponential speedup is expected on quantum computers, but the algorithms proposed so far are based on real time evolution of the wavefunction, which requires high-depth circuits and hence very low noise levels in the quantum hardware. Here we propose an alternative approach, which uses the variational quantum eigensolver (VQE) method for ground and excited states to obtain the needed quantities as part of an exact diagonalization impurity solver. We present the algorithm for a two site DMFT system, which we benchmark using simulations on conventional computers as well as experiments on superconducting and trapped ion qubits, demonstrating that this method is suitable for running DMFT calculations on currently available quantum hardware.
The developments of quantum computing algorithms and experiments for atomic scale simulations have largely focused on quantum chemistry for molecules, while their application in condensed matter systems is scarcely explored. Here we present a quantum algorithm to perform dynamical mean field theory (DMFT) calculations for condensed matter systems on currently available quantum computers, and demonstrate it on two quantum hardware platforms. DMFT is required to properly describe the large class of materials with strongly correlated electrons. The computation-ally challenging part arises from solving the effective problem of an interacting impurity coupled to a bath, which scales exponentially with system size on conventional computers. An exponential speedup is expected on quantum computers, but the algorithms proposed so far are based on real time evolution of the wavefunction, which requires high-depth circuits and hence very low noise levels in the quantum hardware. Here we propose an alternative approach, which uses the variational quantum eigensolver (VQE) method for ground and excited states to obtain the needed quantities as part of an exact diagonalization impurity solver. We present the algorithm for a two site DMFT system, which we benchmark using simulations on conventional computers as well as experiments on superconducting and trapped ion qubits, demonstrating that this method is suitable for running DMFT calculations on currently available quantum hardware.
Quantum algorithms offer an exponential speedup over classical algorithms for a range of computational problems. The fundamental mechanisms underlying quantum computation required the development and construction of quantum computers. These devices are referred to as NISQ (Noisy Intermediate-Scale Quantum) devices. Not only are NISQ devices extremely limited in their qubit count but they also suffer from noise during computation and this problem only gets worse as the size of the circuit increases which limits the practical use of quantum computers for modern day applications. This paper will focus on utilizing quantum circuit partitioning to overcome the inherent issues of NISQ devices. Partitioning a quantum circuit into smaller subcircuits has allowed for the execution of quantum circuits that are too large to fit on one quantum device. There have been many previous approaches to quantum circuit partitioning and each of these approaches differ in how they work with some focusing on hardware-aware partitioning, optimal graph-based partitioning, multi-processor architectures and many more. These approaches achieve success in their objective but they often fail to scale well which impacts cost and noise. The ultimate goal of this paper is to mitigate these issues by minimizing 3 important metrics; noise, time and cost. To achieve this we use dynamic partitioning for practical circuit cutting and we take advantage of the benefits of hybrid execution where classical computation will be used alongside quantum hardware. This approach has proved to be beneficial with respect to noise with classical execution enabling a 42.30% reduction in noise and a 40% reduction in the number of qubits required in cases where a mixture of classical and quantum computation were required.
The current phase of quantum computing is in the Noisy Intermediate-Scale Quantum (NISQ) era. On NISQ devices, two-qubit gates such as CNOTs are much noisier than single-qubit gates, so it is essential to minimize their count. Quantum circuit synthesis is a process of decomposing an arbitrary unitary into a sequence of quantum gates, and can be used as an optimization tool to produce shorter circuits to improve overall circuit fidelity. However, the time-to-solution of synthesis grows exponentially with the number of qubits. As a result, synthesis is intractable for circuits on a large qubit scale.
In this paper, we propose a hierarchical, block-by-block optimization framework, QGo, for quantum circuit optimization. Our approach allows an exponential cost optimization to scale to large circuits. QGo uses a combination of partitioning and synthesis: 1) partition the circuit into a sequence of independent circuit blocks; 2) re-generate and optimize each block using quantum synthesis; and 3) re-compose the final circuit by stitching all the blocks together. We perform our analysis and show the fidelity improvements in three different regimes: small-size circuits on real devices, medium-size circuits on noise simulations, and large-size circuits on analytical models. Using a set of NISQ benchmarks, we show that QGo can reduce the number of CNOT gates by 29.9% on average and up to 50% when compared with industrial compilers such as t|ket>. When executed on the IBM Athens system, shorter depth leads to higher circuit fidelity. We also demonstrate the scalability of our QGo technique to optimize circuits of 60+ qubits. Our technique is the first demonstration of successfully employing and scaling synthesis in the compilation toolchain for large circuits. Overall, our approach is robust for direct incorporation in production compiler toolchains.
Noisy Intermediate-Scale Quantum (NISQ) devices fail to produce outputs with sufficient fidelity for deep circuits with many gates today. Such devices suffer from read-out, multi-qubit gate and crosstalk noise combined with short decoherence times limiting circuit depth. This work develops a methodology to generate shorter circuits with fewer multi-qubit gates whose unitary transformations approximate the original reference one. It explores the benefit of such generated approximations under NISQ devices. Experimental results with Grover's algorithm, multiple-control Toffoli gates, and the Transverse Field Ising Model show that such approximate circuits produce higher fidelity results than longer, theoretically precise circuits on NISQ devices, especially when the reference circuits have many CNOT gates to begin with. With this ability to fine-tune circuits, it is demonstrated that quantum computations can be performed for more complex problems on today's devices than was feasible before, sometimes even with a gain in overall precision by up to 60%.