Hybrid Method of Efficient Simulation of Physics Applications for a Quantum Computer

Fuente: arXiv
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Autori principali: Rieger, Carla, Schmitz, Albert T., Salem, Gehad, Incudini, Massimiliano, Vallecorsa, Sofia, Matsuura, Anne Y., Grossi, Michele, Guerreschi, Gian Giacomo
Natura: Preprint
Pubblicazione: 2026
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author Rieger, Carla
Schmitz, Albert T.
Salem, Gehad
Incudini, Massimiliano
Vallecorsa, Sofia
Matsuura, Anne Y.
Grossi, Michele
Guerreschi, Gian Giacomo
author_facet Rieger, Carla
Schmitz, Albert T.
Salem, Gehad
Incudini, Massimiliano
Vallecorsa, Sofia
Matsuura, Anne Y.
Grossi, Michele
Guerreschi, Gian Giacomo
contents Quantum chemistry and materials science are among the most promising areas for demonstrating algorithmic quantum advantage and quantum utility due to their inherent quantum mechanical nature. Still, large-scale simulations of quantum circuits are essential for determining the problem size at which quantum solutions outperform classical methods. In this work, we present a novel hybrid simulation approach, forming a hybrid of a fullstate and a Clifford simulator, specifically designed to address the computational challenges associated with the time evolution of quantum chemistry Hamiltonians. Our method focuses on the efficient emulation of multi-qubit rotations, a critical component of Trotterized Hamiltonian evolution. By optimizing the representation and execution of multi-qubit operations leveraging the Pauli frame, our approach significantly reduces the computational cost of simulating quantum circuits, enabling more efficient simulations. Beyond its impact on chemistry applications, our emulation strategy has broad implications for any computational workload that relies heavily on multi-qubit rotations. By increasing the efficiency of quantum simulations, our method facilitates more accurate and cost-effective studies of complex quantum systems. We quantify the performance improvements and computational savings for this emulation strategy, and we obtain a speedup of a factor $\approx 18$ ($\approx 22$ with MPI) for our evaluated chemistry Hamiltonians with 24 qubits. Thus, we evaluate our integration of this emulation strategy into the Intel Quantum SDK, further bridging the gap between theoretical algorithm development and practical quantum software implementations.
format Preprint
id arxiv_https___arxiv_org_abs_2602_09020
institution arXiv
publishDate 2026
record_format arxiv
spellingShingle Hybrid Method of Efficient Simulation of Physics Applications for a Quantum Computer
Rieger, Carla
Schmitz, Albert T.
Salem, Gehad
Incudini, Massimiliano
Vallecorsa, Sofia
Matsuura, Anne Y.
Grossi, Michele
Guerreschi, Gian Giacomo
Quantum Physics
Quantum chemistry and materials science are among the most promising areas for demonstrating algorithmic quantum advantage and quantum utility due to their inherent quantum mechanical nature. Still, large-scale simulations of quantum circuits are essential for determining the problem size at which quantum solutions outperform classical methods. In this work, we present a novel hybrid simulation approach, forming a hybrid of a fullstate and a Clifford simulator, specifically designed to address the computational challenges associated with the time evolution of quantum chemistry Hamiltonians. Our method focuses on the efficient emulation of multi-qubit rotations, a critical component of Trotterized Hamiltonian evolution. By optimizing the representation and execution of multi-qubit operations leveraging the Pauli frame, our approach significantly reduces the computational cost of simulating quantum circuits, enabling more efficient simulations. Beyond its impact on chemistry applications, our emulation strategy has broad implications for any computational workload that relies heavily on multi-qubit rotations. By increasing the efficiency of quantum simulations, our method facilitates more accurate and cost-effective studies of complex quantum systems. We quantify the performance improvements and computational savings for this emulation strategy, and we obtain a speedup of a factor $\approx 18$ ($\approx 22$ with MPI) for our evaluated chemistry Hamiltonians with 24 qubits. Thus, we evaluate our integration of this emulation strategy into the Intel Quantum SDK, further bridging the gap between theoretical algorithm development and practical quantum software implementations.
title Hybrid Method of Efficient Simulation of Physics Applications for a Quantum Computer
topic Quantum Physics
url https://arxiv.org/abs/2602.09020