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arXiv:2606.31351

A Quantum-Classical Surrogate Model for the Collision Operator of the Lattice Boltzmann Method

Lukas C. Birk, David M. Wawrzyniak, Josef M. Winter, Steffen J. Schmidt, Thomas Indinger, Christian F. Janßen, Nikolaus A. Adams

quant-phSubmitted Jun 30, 2026• Announced Jul 1, 2026• 0 citations
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Abstract

We introduce a hybrid approach utilising a quantum machine learning surrogate model to approximate the non-linear collision dynamics of the LBM. It effectively offloads the non-unitary operations that challenge pure quantum solvers. The expressivity of the surrogate is built on the ability of parameterised quantum circuits to implement partial Fourier series, with data re-uploading extending the spectrum of representable frequencies. Unlike previous approaches with a fixed relaxation parameter, the surrogate recovers the complete Bhatnagar-Gross-Krook (BGK) collision dynamics across the full physically admissible range of relaxation without retraining. We reassess the relevance of standard variational quantum circuit (VQC) metrics, including expressibility, entanglement, and effective dimension, by relating them directly to task-specific surrogate performance and identifying the key architectural parameters that determine approximation accuracy. The proposed surrogate is validated against the classical BGK collision operator using established benchmark problems, including the Taylor-Green vortex for evaluating energy dissipation and the double shear layer for assessing shear-driven instabilities and nonlinear flow evolution. Our results demonstrate that the hybrid model achieves high accuracy and generalisability while closely replicating classical solutions. These findings suggest that hybrid quantum-classical strategies offer a practical path toward realising the potential of quantum computing in fluid engineering.

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ABSTRACT This study introduces a framework for learning a low‐depth surrogate quantum circuit (SQC) that approximates the nonlinear, dissipative, and hence non‐unitary Bhatnagar–Gross–Krook (BGK) collision operator in the lattice Boltzmann method (LBM) for the lattice. By appropriately selecting the quantum state encoding, circuit architecture, and measurement protocol, non‐unitary dynamics emerge naturally within the physical population space. This approach removes the need for probabilistic algorithms relying on ancilla qubits and post‐selection to reproduce dissipation, or for multiple state copies to capture nonlinearity. The SQC is designed to preserve key physical properties of the BGK operator, including mass conservation, scale equivariance, and equivariance, while momentum conservation is encouraged through penalization in the training loss. When compiled to the IBM Heron quantum processor's native gate set, assuming all‐to‐all qubit connectivity, the circuit requires only 724 native gates and operates locally on the velocity register, making it independent of the lattice size. The learned SQC is validated on two benchmark cases, the Taylor–Green vortex decay and the lid‐driven cavity, showing accurate reproduction of vortex decay and flow recirculation. While integration of the SQC into a quantum LBM framework presently requires measurement and re‐initialization at each timestep, the necessary steps towards a measurement‐free formulation are outlined.

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In the existing quantum algorithms for the lattice Boltzmann method, resolving the unitarity problem of the BGK collision operator from first principles remains a fundamental challenge, and a systematically constructed unitary alternative that reproduces the BGK relaxation structure to leading order has not yet been established in the literature. In this work, we propose a novel quantum lattice Boltzmann method (QLBM) based on the rotation collision operator, in which the non-unitary BGK relaxation is replaced by a unitary rotation in the amplitude space of the distribution function, and the corresponding gate-level quantum circuits are also constructed. Specifically, the rotation collision operator is developed for both the D2Q5 model of the convection-diffusion equation and the D2Q9 model of the incompressible Navier--Stokes equations. It is worth noting that, for the D2Q5 model, the equilibrium-state preparation circuit can be precompiled and reused, and the resulting unitary blocks can be sequentially composed once the state-dependent collision parameters are specified. Finally, some numerical experiments are performed to validate the developed QLBM, demonstrating its accuracy and effectiveness.

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Benchmarking One-Dimensional Quantum Lattice Boltzmann Methods on Quantum Hardware

Melvina Quartey, Lucy T. Zhang

Classical computational fluid dynamics (CFD) methods encounter significant computational bottlenecks in large systems and at high Reynolds number flows due to the rapid increase in degrees of freedom, even on flagship supercomputers. As quantum computers emerge, the Quantum Lattice Boltzmann Method (QLBM) has been proposed as a quantum-native alternative for solving fluid dynamics problems. However, until recently, nearly all studies have relied on classical quantum simulators rather than real quantum hardware. This study presents a benchmark of a one-dimensional QLBM implementation executed on three different IBM Quantum hardware. We design and test a quantum circuit for the advection-diffusion equation using amplitude encoding, a Bhatnagar-Gross-Krook (BGK)-type collision operator, and a streaming step with periodic boundary conditions. Our numerical experiments evaluate transpiled two-qubit gate count, total circuit depth, runtime, and accuracy metrics including maximum absolute error ($L_\infty$ norm) and root-mean-square error (RMSE). We find that the present collision and streaming operators dominate the overall cost and become the primary scalability bottleneck on current hardware. To mitigate the prohibitive cost of full quantum state tomography on hardware-based benchmarking exercises, we introduce a sampler-based measurement strategy that reconstructs macroscopic density fields directly from computational-basis measurements. This approach substantially reduces measurement overhead while preserving the expected advection-diffusion dynamics on hardware. These results provide a quantitative assessment of QLBM performance in the noisy intermediate-scale quantum (NISQ) regime and identify the principal algorithmic and experimental limitations that must be addressed for QLBM to become viable for fluid dynamics.

physics.comp-phCross-listedarXiv:2610.40851•Nov 2, 2026
We introduce a hybrid approach utilising a quantum machine learning surrogate model to approximate the non-linear collision dynamics of the LBM. It effectively offloads the non-unitary operations that challenge pure quantum solvers. The expressivity of the surrogate is built on the ability of parameterised quantum circuits to implement partial Fourier series, with data re-uploading extending the spectrum of representable frequencies. Unlike previous approaches with a fixed relaxation parameter, the surrogate recovers the complete Bhatnagar-Gross-Krook (BGK) collision dynamics across the full physically admissible range of relaxation without retraining. We reassess the relevance of standard variational quantum circuit (VQC) metrics, including expressibility, entanglement, and effective dimension, by relating them directly to task-specific surrogate performance and identifying the key architectural parameters that determine approximation accuracy. The proposed surrogate is validated against the classical BGK collision operator using established benchmark problems, including the Taylor-Green vortex for evaluating energy dissipation and the double shear layer for assessing shear-driven instabilities and nonlinear flow evolution. Our results demonstrate that the hybrid model achieves high accuracy and generalisability while closely replicating classical solutions. These findings suggest that hybrid quantum-classical strategies offer a practical path toward realising the potential of quantum computing in fluid engineering.
ABSTRACT This study introduces a framework for learning a low‐depth surrogate quantum circuit (SQC) that approximates the nonlinear, dissipative, and hence non‐unitary Bhatnagar–Gross–Krook (BGK) collision operator in the lattice Boltzmann method (LBM) for the lattice. By appropriately selecting the quantum state encoding, circuit architecture, and measurement protocol, non‐unitary dynamics emerge naturally within the physical population space. This approach removes the need for probabilistic algorithms relying on ancilla qubits and post‐selection to reproduce dissipation, or for multiple state copies to capture nonlinearity. The SQC is designed to preserve key physical properties of the BGK operator, including mass conservation, scale equivariance, and equivariance, while momentum conservation is encouraged through penalization in the training loss. When compiled to the IBM Heron quantum processor's native gate set, assuming all‐to‐all qubit connectivity, the circuit requires only 724 native gates and operates locally on the velocity register, making it independent of the lattice size. The learned SQC is validated on two benchmark cases, the Taylor–Green vortex decay and the lid‐driven cavity, showing accurate reproduction of vortex decay and flow recirculation. While integration of the SQC into a quantum LBM framework presently requires measurement and re‐initialization at each timestep, the necessary steps towards a measurement‐free formulation are outlined.
This study investigates the application of quantum machine learning (QML) to approximate the nonlinear component of the collision operator within the quantum lattice Boltzmann method (QLBM). To achieve this, we train a variational quantum circuit (VQC) to construct an operator UUU. When applied to the post-linear-collision quantum state ∣Ψi⟩\ket{Ψ_i}∣Ψi​⟩, this operator yields a final state ∣Ψf⟩=U∣Ψi⟩\ket{Ψ_f} = U\ket{Ψ_i}∣Ψf​⟩=U∣Ψi​⟩ that successfully replicates the nonlinear collision dynamics derived from the Bhatnagar-Gross-Krook (BGK) approximation. Within this framework, we present two distinct architectures: the R1 model and the R2 model. The R1 model is designed for quantum simulations that involve multiple time steps without intermediate measurements, focusing on accurately capturing nonlinear dynamics in continuous evolution. In contrast, the R2 model is tailored to achieve the high-precision reconstruction of the nonlinear operator for a single time step with an unitary operator.
Quantum computing (QC) has emerged as a potential computational tool in fluid dynamics. However, a practical QC protocol with end-to-end practical applications to fluid flow is still in nascent. We here propose a simple and practical hybrid QC algorithm based on lattice Boltzmann methods (LBM), which we term HQLBM, for fluid dynamics simulations. The existing QC-based LBMs are limited to simple low-Reynolds-number flow simulations due to their disability to handle the nonlinear collision term in LBM for QC. In this work, a linearized non-equilibrium collision, derived from kinetic theory, is presented for HQLBM simulating practical flows. The present approach ensures the unitary of quantum algorithms while keeping the collision relaxation parameter adjustable for simulating different Reynolds number flows. Most importantly, the linearized collision keeps the accuracy of the original nonlinear one in the lattice Boltzmann equation when it theoretically recovers its macroscopic counterpart—Navier–Stokes equations. The practicality of the proposed method is demonstrated by simulating two typical flows, including lid-driven and natural convection flows in a square cavity at different Reynolds and Rayleigh numbers, respectively. It is shown that the proposed HQLBM has good numerical accuracy compared to the conventional LBM, and lower complexity on comparisons to the QC-based LBM carried out on single-circuit QC even when it is performed on a Qiskit virtual quantum computer. This work offers a practical application of QC-based LBM for complex fluid dynamics problems.
In the existing quantum algorithms for the lattice Boltzmann method, resolving the unitarity problem of the BGK collision operator from first principles remains a fundamental challenge, and a systematically constructed unitary alternative that reproduces the BGK relaxation structure to leading order has not yet been established in the literature. In this work, we propose a novel quantum lattice Boltzmann method (QLBM) based on the rotation collision operator, in which the non-unitary BGK relaxation is replaced by a unitary rotation in the amplitude space of the distribution function, and the corresponding gate-level quantum circuits are also constructed. Specifically, the rotation collision operator is developed for both the D2Q5 model of the convection-diffusion equation and the D2Q9 model of the incompressible Navier--Stokes equations. It is worth noting that, for the D2Q5 model, the equilibrium-state preparation circuit can be precompiled and reused, and the resulting unitary blocks can be sequentially composed once the state-dependent collision parameters are specified. Finally, some numerical experiments are performed to validate the developed QLBM, demonstrating its accuracy and effectiveness.
We present a full quantum algorithm for the lattice Boltzmann method for simulating fluid flows, the only such algorithm to implement both the streaming and collision substeps as unitary operators using an efficient number of qubits. We use Hamiltonian simulation as the main route underlying the algorithm, and show that it uses qubits that scale logarithmically in the flow Reynolds number but gates that scale only polynomially. We motivate the discussion by a brief overview of existing attempts at simulating classical fluids on quantum computers and present a pedagogical discussion on assigning quantum operators to classical variables in both the streaming and the collision substeps, after highlighting the incompatibility of the latter with the implementations of the streaming step that exists in the literature. We use the Bhatnagar–Gross–Krook ansatz for the collision term, representing the relaxation toward an equilibrium distribution. For nonlinear collisions, we use Kowalski's framework that links the nonlinear dynamics of a system to the evolution of bosonic modes, assigning a Carleman linearization order to the truncation in the Fock space of the bosons. We present the qubit and gate complexities, in terms of the chosen accuracy and the Reynolds number. In the Appendix, we work out the details of implementing the operators of the truncated bosonic Fock space in terms of single-qubit gates as well as the error scaling for a general polynomial driving function.
Classical computational fluid dynamics (CFD) methods encounter significant computational bottlenecks in large systems and at high Reynolds number flows due to the rapid increase in degrees of freedom, even on flagship supercomputers. As quantum computers emerge, the Quantum Lattice Boltzmann Method (QLBM) has been proposed as a quantum-native alternative for solving fluid dynamics problems. However, until recently, nearly all studies have relied on classical quantum simulators rather than real quantum hardware. This study presents a benchmark of a one-dimensional QLBM implementation executed on three different IBM Quantum hardware. We design and test a quantum circuit for the advection-diffusion equation using amplitude encoding, a Bhatnagar-Gross-Krook (BGK)-type collision operator, and a streaming step with periodic boundary conditions. Our numerical experiments evaluate transpiled two-qubit gate count, total circuit depth, runtime, and accuracy metrics including maximum absolute error (L∞L_\inftyL∞​ norm) and root-mean-square error (RMSE). We find that the present collision and streaming operators dominate the overall cost and become the primary scalability bottleneck on current hardware. To mitigate the prohibitive cost of full quantum state tomography on hardware-based benchmarking exercises, we introduce a sampler-based measurement strategy that reconstructs macroscopic density fields directly from computational-basis measurements. This approach substantially reduces measurement overhead while preserving the expected advection-diffusion dynamics on hardware. These results provide a quantitative assessment of QLBM performance in the noisy intermediate-scale quantum (NISQ) regime and identify the principal algorithmic and experimental limitations that must be addressed for QLBM to become viable for fluid dynamics.