HIVQE: Handover Iterative Variational Quantum Eigensolver for Efficient Quantum Chemistry Calculations

• URL: http://arxiv.org/abs/2503.06292v2
• Date: Sun, 16 Mar 2025 11:56:06 GMT
• Title: HIVQE: Handover Iterative Variational Quantum Eigensolver for Efficient Quantum Chemistry Calculations
• Authors: Aidan Pellow-Jarman, Shane McFarthing, Doo Hyung Kang, Pilsun Yoo, Eyuel Eshetu Elala, Rowan Pellow-Jarman, P. Mai Nakliang, Jaewan Kim, June-Koo Kevin Rhee,
• Abstract summary: The Handover Iterative Variational Quantum Eigensolver (HiVQE) is designed to accurately estimate ground-state wavefunctions.<n>By generating compact yet chemically accurate wavefunctions, HiVQE advances quantum chemistry simulations and facilitates the discovery of novel materials.
• Score: 0.18574358541506214
• License: http://creativecommons.org/licenses/by-nc-nd/4.0/
• Abstract: A novel hybrid quantum-classical approach has been developed to efficiently address the multireference quantum chemistry problem. The Handover Iterative Variational Quantum Eigensolver (HiVQE) is designed to accurately estimate ground-state wavefunctions by leveraging both quantum and classical computing resources. In this framework, noisy intermediate-scale quantum (NISQ) hardwares efficiently explore electron configurations, while classical computers compute the corresponding wavefunction without the effect of noise of NISQ computer, ensuring both accuracy and computational efficiency. By generating compact yet chemically accurate wavefunctions, HiVQE advances quantum chemistry simulations and facilitates the discovery of novel materials. This approach demonstrates significant potential for overcoming the limitations of classical methods in strongly correlated electronic systems.

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