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Classically Driven Hybrid Quantum Algorithms with Sequential Givens Rotations for Reduced Measurement Cost

Quantum Physics 2026-03-10 v1 Chemical Physics

Abstract

Quantum algorithms for electronic-structure simulations are actively being developed, yet many hybrid quantum-classical approaches are bottlenecked by the measurement overhead associated with large molecular Hamiltonians. Here we introduce a diagonalization-driven framework that progressively drives the electronic Hamiltonian toward a (block-)diagonal form in the Slater-determinant basis using sequential Givens rotations. In contrast to Schr\"odinger-picture methods that variationally optimize a wave function, our approach adopts a Heisenberg-picture viewpoint: the Hamiltonian is iteratively transformed, and rotation angles are determined classically from low-dimensional effective blocks, reducing the quantum workload to a small, fixed set of matrix-element measurements per iteration. Candidate generators are estimated via approximate Baker-Campbell-Hausdorff updates with truncation and cumulant-based approximations that control Hamiltonian growth, complemented by stochastic selection to avoid stagnation. We further introduce an angle-merging procedure that reduces circuit depth by consolidating repeated small-angle rotations. We benchmark the framework on N2_2 and strongly correlated hydrogen systems, assessing convergence behavior, residual-structure diagnostics, measurement-accuracy trade-offs, circuit costs, and robustness under finite sampling.

Keywords

Cite

@article{arxiv.2603.08025,
  title  = {Classically Driven Hybrid Quantum Algorithms with Sequential Givens Rotations for Reduced Measurement Cost},
  author = {Benjamin Mokhtar and Noboru Inoue and Takashi Tsuchimochi},
  journal= {arXiv preprint arXiv:2603.08025},
  year   = {2026}
}
R2 v1 2026-07-01T11:09:45.255Z