Meta-Learning for GPU-Accelerated Quantum Many-Body Problems

Fuente: arXiv
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Autori principali: Chen, Yun-Hsuan, Chang, Jen-Yu, Huang, Tsung-Wei, Kuo, En-Jui
Natura: Preprint
Pubblicazione: 2026
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author Chen, Yun-Hsuan
Chang, Jen-Yu
Huang, Tsung-Wei
Kuo, En-Jui
author_facet Chen, Yun-Hsuan
Chang, Jen-Yu
Huang, Tsung-Wei
Kuo, En-Jui
contents We explore the industrial and scientific applicability of the VQE-LSTM framework by integrating meta-learning with GPU accelerated quantum simulation using NVIDIA's CUDA-Q (CUDAQ) platform. This work demonstrates how an LSTM-FC meta-initialization module can extend the practical reach of the Variational Quantum Eigensolver (VQE) in both chemistry and physics domains. In the chemical regime, the framework predicts ground-state energies of molecular Hamiltonians derived from PySCF, achieving near FCI accuracy while maintaining favorable O(N^2) scaling with molecular size. In the physical counterpart, we applied the same model to quantized Simple Harmonic Motion systems (SHM), successfully reproducing its ground and excited states through VQE and Variational Quantum Deflation (VQD) methods. Benchmark results on NVIDIA GPUs reveal significant speedups over CPU-based implementations, validating CUDAQ's capability to handle large-scale variational workloads efficiently. Overall, this study establishes VQE-LSTM as a viable and scalable approach for GPU accelerated quantum simulation, bridging quantum chemistry and condensed-matter physics through a unified, meta-learned initialization strategy.
format Preprint
id arxiv_https___arxiv_org_abs_2602_15706
institution arXiv
publishDate 2026
record_format arxiv
spellingShingle Meta-Learning for GPU-Accelerated Quantum Many-Body Problems
Chen, Yun-Hsuan
Chang, Jen-Yu
Huang, Tsung-Wei
Kuo, En-Jui
Quantum Physics
We explore the industrial and scientific applicability of the VQE-LSTM framework by integrating meta-learning with GPU accelerated quantum simulation using NVIDIA's CUDA-Q (CUDAQ) platform. This work demonstrates how an LSTM-FC meta-initialization module can extend the practical reach of the Variational Quantum Eigensolver (VQE) in both chemistry and physics domains. In the chemical regime, the framework predicts ground-state energies of molecular Hamiltonians derived from PySCF, achieving near FCI accuracy while maintaining favorable O(N^2) scaling with molecular size. In the physical counterpart, we applied the same model to quantized Simple Harmonic Motion systems (SHM), successfully reproducing its ground and excited states through VQE and Variational Quantum Deflation (VQD) methods. Benchmark results on NVIDIA GPUs reveal significant speedups over CPU-based implementations, validating CUDAQ's capability to handle large-scale variational workloads efficiently. Overall, this study establishes VQE-LSTM as a viable and scalable approach for GPU accelerated quantum simulation, bridging quantum chemistry and condensed-matter physics through a unified, meta-learned initialization strategy.
title Meta-Learning for GPU-Accelerated Quantum Many-Body Problems
topic Quantum Physics
url https://arxiv.org/abs/2602.15706