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Paul Over

Publications and source records attributed to Paul Over.

6 recordsLinked to original sources

Operator Learning for efficient Quantum Computation

An efficient implementation of quantum algorithms is often hindered by the lack of efficient primitives for operators and state preparation. This limits both the ability of near-term quantum hardware to simulate complex problems and the potential of fault-tolerant algorithms to achieve practical quantum advantage. To address this, we propose a full-stack variational framework that transforms arbitrary operators to compact quantum circuits. The resulting variational circuits can be tailored to the connectivity and long-range interaction of the target hardware. The learning process employs backpropagation together with a cost function that efficiently optimizes unitary operators and non-unitary -- dense or sparse -- operators using only a single ancilla qubit for block encoding. Additionally, we introduce a regularization term that reduces the approximation error. The approach is validated for both quantum mechanical and engineering applications. In the former case, we learn propagators that arise in native quantum problems -- such as quantum simulation and quantum chemistry -- and achieve improved resource scaling in comparison to standard Suzuki-Trotter expansions. In the latter case, we demonstrate the approach's ability to implement the second-order central finite difference approximation of the Laplace operator -- relevant for solving partial differential equations -- while improving upon current error metrics. The final example deals with learning a dense, non-unitary operator that arises in the analysis of inviscid potential flow around an airfoil. This universality of the framework opens the door for solving general problems beyond prototypical engineering and quantum applications.

quant-ph

Quantum time-marching algorithms for solving linear transport problems including boundary conditions

This article presents the first complete application of a quantum time-marching algorithm for simulating multidimensional linear transport phenomena with arbitrary boundaries, whereby the success probabilities are problem intrinsic. The method adapts the linear combination of unitaries algorithm to block encode the diffusive dynamics, while arbitrary boundary conditions are enforced by the method of images only at the cost of one additional qubit per spatial dimension. As an alternative to the non-periodic reflection, the direct encoding of Neumann conditions by the unitary decomposition of the discrete time-marching operator is proposed. All presented algorithms indicate optimal success probabilities while maintaining linear time complexity, thereby securing the practical applicability of the quantum algorithm on fault-tolerant quantum computers. The proposed time-marching method is demonstrated through state-vector simulations of the heat equation in combination with Neumann, Dirichlet, and mixed boundary conditions.

quant-ph

Quantum-Inspired Tensor-Network Fractional-Step Method for Incompressible Flow in Curvilinear Coordinates

We introduce an algorithmic framework based on tensor networks for computing fluid flows around immersed objects in curvilinear coordinates. We show that the tensor network simulations can be carried out solely using highly compressed tensor representations of the flow fields and the differential operators and discuss the numerical implementation of the tensor operations required for computing fluid flows in detail. The applicability of our method is demonstrated by applying it to the paradigm example of steady and transient flows around stationary and rotating cylinders. We find excellent quantitative agreement in comparison to finite difference simulations for Strouhal numbers, forces and velocity fields. The properties of our approach are discussed in terms of reduced order models. We estimate the memory saving and potential runtime advantages in comparison to standard finite difference simulations. We find accurate results with errors of less than 0.3% for flow-field compressions by a factor of up to 20 and differential operators compressed by factors of up to 1000 compared to sparse matrix representations. We provide strong numerical evidence that the runtime scaling advantages of the tensor network approach with system size will provide substantial resource savings when simulating larger systems. Finally, we note that, like other tensor network-based fluid flow simulations, our algorithmic framework is directly portable to a quantum computer leading to further scaling advantages.

physics.flu-dyn

Towards Variational Quantum Algorithms for generalized linear and nonlinear transport phenomena

This article proposes a Variational Quantum Algorithm to solve linear and nonlinear thermofluid dynamic transport equations. The hybrid classical-quantum framework is applied to problems governed by the heat, wave, and Burgers' equation in combination with different engineering boundary conditions. Topics covered include the encoding of band matrices, as in the consideration of non-constant material properties and upwind-biased first- and higher-order approximations, widely used in engineering Computational Fluid Dynamics, by the use of a mask function. Verification examples demonstrate high predictive agreement with classical methods. Furthermore, the scalability analysis shows a polylog scaling of the number of quantum gates with the number of qubits. Remaining challenges refer to the implicit construction of upwind schemes and the identification of an appropriate parameterization strategy of the quantum ansatz.

quant-ph

Quantum Algorithm for the Advection-Diffusion Equation by Direct Block Encoding of the Time-Marching Operator

A quantum algorithm for simulating multidimensional scalar transport problems using a time-marching strategy is presented. A direct unitary block encoding of the explicit time-marching operator is constructed, resulting in the intrinsic success probability of the squared solution norm without the need for amplitude amplification, thereby retaining a linear dependence on the simulation time. The algorithm separates the explicit time-marching operator into an advection-like component and a corrective shift operator. The advection-like component is mapped to a Hamiltonian simulation and combined with the shift operator through the linear combination of unitaries algorithm. State-vector simulations of a scalar transported in a steady two-dimensional Taylor-Green vortex support the theoretical findings.

quant-ph

Boundary Treatment for Variational Quantum Simulations of Partial Differential Equations on Quantum Computers

The paper presents a variational quantum algorithm to solve initial-boundary value problems described by second-order partial differential equations. The approach uses hybrid classical/quantum hardware that is well suited for quantum computers of the current noisy intermediate-scale quantum era. The partial differential equation is initially translated into an optimal control problem with a modular control-to-state operator (ansatz). The objective function and its derivatives required by the optimizer can efficiently be evaluated on a quantum computer by measuring an ancilla qubit, while the optimization procedure employs classical hardware. The focal aspect of the study is the treatment of boundary conditions, which is tailored to the properties of the quantum hardware using a correction technique. For this purpose, the boundary conditions and the discretized terms of the partial differential equation are decomposed into a sequence of unitary operations and subsequently compiled into quantum gates. The accuracy and gate complexity of the approach are assessed for second-order partial differential equations by classically emulating the quantum hardware. The examples include steady and unsteady diffusive transport equations for a scalar property in combination with various Dirichlet, Neumann, or Robin conditions. The results of this flexible approach display a robust behavior and a strong predictive accuracy in combination with a remarkable polylog complexity scaling in the number of qubits of the involved quantum circuits. Remaining challenges refer to adaptive ansatz strategies that speed up the optimization procedure.

quant-ph