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Journal of Visualized Experiments

Neural Network-Guided Extrapolation Technique for Quantum Variational Algorithms

Subhasree Bhattacharjee, Soumyadip Sarkar, Kunal Das, Hanin Ardah, Abdel‐Haleem Abdel‐Aty, Ali Jaber Almalki

Published Oct 10, 2025• 1 citation
Publisher

Abstract

In the noisy intermediate-scale quantum (NISQ) era, the Variational Quantum Eigensolver (VQE) comes out as an effective algorithm for addressing complex quantum challenges. However, the presence of noise in quantum devices frequently reduces the accuracy and reliability of VQE outcomes. This paper presents an innovative method to address this issue by using a neural network-based extrapolation technique in VQE calculation. By utilizing the Qiskit framework, we designed parameterized quantum circuits using the RY-RZ ansatz, and their performance was analyzed under different levels of depolarizing noise with bit-flip errors, phase-flip errors, and amplitude damping errors. Our inquiry involved analyzing the expected outcomes of a Hamiltonian across various levels of noise intensity with the objective of deducing the ground state energy (GSE). To connect the observed noisy outcomes with the ideal noise-free condition, a Feedforward Neural Network (FFNN) was trained using the error probabilities and their corresponding expectation values. This model accurately predicted the VQE results in an ideal noise-free scenario. Comparison of the result of simulation and real quantum hardware executions revealed noise-induced inconsistencies, highlighting the effectiveness of this neural network-based extrapolation approach in correcting them. This comprehensive method improves the accuracy of VQE calculation on NISQ devices and highlights the significant potential of blending quantum and classical methods to address the threats imposed by quantum noise. The comparison of results between FFNN, convolutional neural network (CNN), and long short-term memory (LSTM) network reveals that FFNN predicts outcomes with more accuracy but in less time.

DOI
10.3791/68873

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In the noisy intermediate-scale quantum (NISQ) era, the Variational Quantum Eigensolver (VQE) comes out as an effective algorithm for addressing complex quantum challenges. However, the presence of noise in quantum devices frequently reduces the accuracy and reliability of VQE outcomes. This paper presents an innovative method to address this issue by using a neural network-based extrapolation technique in VQE calculation. By utilizing the Qiskit framework, we designed parameterized quantum circuits using the RY-RZ ansatz, and their performance was analyzed under different levels of depolarizing noise with bit-flip errors, phase-flip errors, and amplitude damping errors. Our inquiry involved analyzing the expected outcomes of a Hamiltonian across various levels of noise intensity with the objective of deducing the ground state energy (GSE). To connect the observed noisy outcomes with the ideal noise-free condition, a Feedforward Neural Network (FFNN) was trained using the error probabilities and their corresponding expectation values. This model accurately predicted the VQE results in an ideal noise-free scenario. Comparison of the result of simulation and real quantum hardware executions revealed noise-induced inconsistencies, highlighting the effectiveness of this neural network-based extrapolation approach in correcting them. This comprehensive method improves the accuracy of VQE calculation on NISQ devices and highlights the significant potential of blending quantum and classical methods to address the threats imposed by quantum noise. The comparison of results between FFNN, convolutional neural network (CNN), and long short-term memory (LSTM) network reveals that FFNN predicts outcomes with more accuracy but in less time.
In the emergent realm of quantum computing, the Variational Quantum Eigensolver (VQE) stands out as a promising algorithm for solving complex quantum problems, especially in the noisy intermediate-scale quantum (NISQ) era. However, the ubiquitous presence of noise in quantum devices often limits the accuracy and reliability of VQE outcomes. This research introduces a novel approach to ameliorate this challenge by utilizing neural networks for zero noise extrapolation (ZNE) in VQE computations. By employing the Qiskit framework, we crafted parameterized quantum circuits using the RY-RZ ansatz and examined their behavior under varying levels of depolarizing noise. Our investigations spanned from determining the expectation values of a Hamiltonian, defined as a tensor product of Z operators, under different noise intensities to extracting the ground state energy. To bridge the observed outcomes under noise with the ideal noise-free scenario, we trained a Feed Forward Neural Network on the error probabilities and their associated expectation values. Remarkably, our model proficiently predicted the VQE outcome under hypothetical noise-free conditions. By juxtaposing the simulation results with real quantum device executions, we unveiled the discrepancies induced by noise and showcased the efficacy of our neural network-based ZNE technique in rectifying them. This integrative approach not only paves the way for enhanced accuracy in VQE computations on NISQ devices but also underlines the immense potential of hybrid quantum-classical paradigms in circumventing the challenges posed by quantum noise. Through this research, we envision a future where quantum algorithms can be reliably executed on noisy devices, bringing us one step closer to realizing the full potential of quantum computing.
Hybrid Quantum Neural Networks (HQNNs) offer promising potential of quantum computing while retaining the flexibility of classical deep learning. However, the limitations of Noisy Intermediate-Scale Quantum (NISQ) devices introduce significant challenges in achieving ideal performance due to noise interference, such as decoherence, gate errors, and readout errors. This paper presents an extensive comparative analysis of two HQNN algorithms, Quantum Convolutional Neural Network (QCNN) and Quanvolutional Neural Network (QuanNN), assessing their noise resilience across diverse image classification tasks. We systematically inject noise into variational quantum circuits using five quantum noise channels: Phase Flip, Bit Flip, Phase Damping, Amplitude Damping, and Depolarizing Noise. By varying noise probabilities from 0.1 to 1.0, we evaluate the correlation between noise robustness and model behavior across different noise levels.Our findings demonstrate that different noise types and levels significantly influence HQNN performance. The QuanNN shows robust performance across most noise channels for low noise levels (0.1 - 0.4), but succumbs to diverse effects of depolarizing and amplitude damping noise at probabilities between (0.5 - 1.0). However, the QuanNN exhibits robustness to bit flip noise at high probabilities (0.9 - 1.0). On the other hand, the QCNN tends to benefit from the noise injection by outperforming noise-free models for bit flip, phase flip, and phase damping at high noise probabilities. However, for other noise types, the QCNN shows gradual performance degradation as noise increases. These insights aim to guide future research in error mitigation strategies to enhance HQNN models in the NISQ era.
We introduce a general framework called neural-network- (NN) encoded variational quantum algorithms (VQAs), or NNVQA for short, to address the challenges of implementing VQAs on noisy intermediate-scale quantum (NISQ) computers. Specifically, NNVQA feeds input (such as parameters of a Hamiltonian) from a given problem to a neural network and uses its outputs to parameterize an ansatz circuit for the standard VQA. Combining the strengths of NN and parameterized quantum circuits, NNVQA can accelerate the training process of VQAs and handle a broad family of related problems with varying input parameters with the pretrained NN. To concretely illustrate the merits of NNVQA, we present results on a NN variational quantum eigensolver (VQE) for solving the ground state of parameterized XXZXXZXXZ spin models in one and two dimensions. Our results demonstrate that NNVQE is able to estimate the ground-state energies of parameterized Hamiltonians with high precision without fine tuning, and significantly reduce the overall training cost to estimate ground-state properties across the phases of the given Hamiltonian. We also employ an active learning strategy to further increase the training efficiency while maintaining prediction accuracy. These encouraging results demonstrate that NNVQAs offer an alternative hybrid quantum-classical paradigm to utilize NISQ resources for solving more realistic and challenging computational problems.
This work focuses on the design and evaluation of Hybrid Quantum Neural Networks (HQNNs) that integrate the computational advantages of quantum circuits with the learning flexibility of classical deep neural networks to enhance machine learning performance in the Noisy Intermediate-Scale Quantum (NISQ) era.The study investigates two prominent HQNN architectures, namely Quantum Convolutional Neural Networks (QCNNs) and Quanvolutional Neural Networks (QuanNNs), with an emphasis on their robustness under realistic quantum noise conditions.It was evaluated using image classification tasks.Under various quantum noise channels, including Bit Flip, Phase Flip, Phase Damping, Amplitude Damping, and Depolarizing Noise, were introduced to reflect realistic hardware conditions.To reduce noise-induced performance loss, error mitigation techniques such as Zero-Noise Extrapolation, Probabilistic Error Cancellation, and Measurement Error Mitigation were applied.In addition, an AI-assisted adaptive framework is proposed to automatically recommend suitable mitigation strategies based on observed noise behavior and circuit characteristics.Experimental results indicate that QuanNN exhibits strong robustness under lowto-moderate noise levels and maintains stable performance even under high bit-flip noise, while QCNN demonstrates occasional performance gains under specific noisy configurations but degrades more rapidly as noise intensity increases.The proposed AI-guided mitigation mechanism further enhances model stability across varying noise regimes.This study provides practical insights into architecture selection, noise resilience, and intelligent error mitigation integration, offering a scalable framework for deploying HQNNs in real-world NISQ-era quantum machine learning applications.
The variational quantum eigensolver (VQE) is a widely employed method to solve electronic structure problems in the current noisy intermediate-scale quantum (NISQ) devices. However, due to inherent noise in the NISQ devices, VQE results on NISQ devices often deviate significantly from the results obtained on noiseless statevector simulators or traditional classical computers. The iterative nature of VQE further amplifies the errors in each loop. Recent works have explored ways to integrate deep neural networks (DNN) with VQE to mitigate iterative errors, albeit primarily limited to the noiseless statevector simulators. In this work, we trained DNN models across various quantum circuits and examined the potential of two DNN-VQE approaches, DNN1 and DNNF, for predicting the ground state energies of small molecules in the presence of device noise. We carefully examined the accuracy of the DNN1, DNNF, and VQE methods on both noisy simulators and real quantum devices by considering different ansatzes of varying qubit counts and circuit depths. Our results illustrate the advantages and limitations of both VQE and DNN-VQE approaches. Notably, both DNN1 and DNNF methods consistently outperform the standard VQE method in providing more accurate ground state energies in noisy environments. However, despite being more accurate than VQE, the energies predicted using these methods on real quantum hardware remain meaningful only at reasonable circuit depths (depth = 15, gates = 21). At higher depths (depth = 83, gates = 112), they deviate significantly from the exact results. Additionally, we find that DNNF does not offer any notable advantage over VQE in terms of speed. Consequently, our study recommends DNN1 as the preferred method for obtaining quick and accurate ground state energies of molecules on current quantum hardware, particularly for quantum circuits with lower depth and fewer qubits.
As a hybrid quantum-classical algorithm, the variational quantum eigensolver is widely applied in quantum chemistry simulations, especially in computing the electronic structure of complex molecular systems. However, on existing noisy intermediate-scale quantum devices, some factors such as quantum decoherence, measurement errors, and gate operation imprecisions are unavoidable. To overcome these challenges, this study proposes an efficient noise-mitigating variational quantum eigensolver for accurate computation of molecular ground state energies in noisy environments. We design the quantum circuit with reference to the structure of matrix product states and utilize it to pre-train the circuit parameters, which ensures circuit stability and mitigates fluctuations caused by initialization. We also employ zero-noise extrapolation to mitigate quantum noise and combine it with neural networks to improve the accuracy of the noise-fitting function, which significantly eliminates noise interference. Furthermore, we implement an intelligent grouping strategy for measuring Hamiltonian Pauli strings, which not only reduces measurement errors but also improves sampling efficiency. We perform numerical simulations to solve the ground state energy of the H4molecule by using MindSpore Quantum framework, and the results demonstrate that our algorithm can constrain noise errors within the range of O(10−2)∼O(10−1)\mathcal{O}\left( {{{10}^{ - 2}}} \right)\sim \mathcal{O}\left( {{{10}^{ - 1}}} \right)O(10−2)∼O(10−1), outperforming mainstream variational quantum eigensolvers. This work provides a new strategy for high-precision quantum chemistry calculations on near-term noisy quantum hardware.