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Transmutation based Quantum Simulation for Non-unitary Dynamics

Shi Jin, Chuwen Ma, Enrique Zuazua

TL;DR

The paper introduces a Kannai-transform–driven quantum algorithm to simulate non-unitary dissipative diffusion generated by $A=L^\dagger L$ by recasting diffusion as a Gaussian-weighted superposition of unitary wave propagators. It combines a first-order unitary embedding with high-order Gaussian quadrature and LCU to achieve a query complexity of $\tilde{O}(\sqrt{\|A\|T\log(1/\varepsilon)})$ and polylogarithmic dependence on the precision, improving over generic Hamiltonian-simulation methods. The authors instantiate the framework for the heat equation, biharmonic diffusion, and viscous Hamilton–Jacobi surrogates, and also develop a long-time regime linear solver with complexity $\tilde{O}(\kappa^{3/2}\log^2(1/\varepsilon))$, illustrating practical quantum advantages for parabolic PDEs. The approach extends to non-normal generators and provides a suite of transmutation-based reductions, including spherical means and transport–heat averaging, broadening the toolbox for non-unitary quantum simulations. Overall, the work offers a versatile, efficient pathway to non-unitary diffusion on quantum hardware with favorable scaling in time, norm, and accuracy.

Abstract

We present a quantum algorithm for simulating dissipative diffusion dynamics generated by positive semidefinite operators of the form $A=L^\dagger L$, a structure that arises naturally in standard discretizations of elliptic operators. Our main tool is the Kannai transform, which represents the diffusion semigroup $e^{-TA}$ as a Gaussian-weighted superposition of unitary wave propagators. This representation leads to a linear-combination-of-unitaries implementation with a Gaussian tail and yields query complexity $\tilde{\mathcal{O}}(\sqrt{\|A\| T \log(1/\varepsilon)})$, up to standard dependence on state-preparation and output norms, improving the scaling in $\|A\|, T$ and $\varepsilon$ compared with generic Hamiltonian-simulation-based methods. We instantiate the method for the heat equation and biharmonic diffusion under non-periodic physical boundary conditions, and we further use it as a subroutine for constant-coefficient linear parabolic surrogates arising in entropy-penalization schemes for viscous Hamilton--Jacobi equations. In the long-time regime, the same framework yields a structured quantum linear solver for $A\mathbf{x}=\mathbf{b}$ with $A=L^\dagger L$, achieving $\tilde{\mathcal{O}}(κ^{3/2}\log^2(1/\varepsilon))$ queries and improving the condition-number dependence over standard quantum linear-system algorithms in this factorized setting.

Transmutation based Quantum Simulation for Non-unitary Dynamics

TL;DR

The paper introduces a Kannai-transform–driven quantum algorithm to simulate non-unitary dissipative diffusion generated by by recasting diffusion as a Gaussian-weighted superposition of unitary wave propagators. It combines a first-order unitary embedding with high-order Gaussian quadrature and LCU to achieve a query complexity of and polylogarithmic dependence on the precision, improving over generic Hamiltonian-simulation methods. The authors instantiate the framework for the heat equation, biharmonic diffusion, and viscous Hamilton–Jacobi surrogates, and also develop a long-time regime linear solver with complexity , illustrating practical quantum advantages for parabolic PDEs. The approach extends to non-normal generators and provides a suite of transmutation-based reductions, including spherical means and transport–heat averaging, broadening the toolbox for non-unitary quantum simulations. Overall, the work offers a versatile, efficient pathway to non-unitary diffusion on quantum hardware with favorable scaling in time, norm, and accuracy.

Abstract

We present a quantum algorithm for simulating dissipative diffusion dynamics generated by positive semidefinite operators of the form , a structure that arises naturally in standard discretizations of elliptic operators. Our main tool is the Kannai transform, which represents the diffusion semigroup as a Gaussian-weighted superposition of unitary wave propagators. This representation leads to a linear-combination-of-unitaries implementation with a Gaussian tail and yields query complexity , up to standard dependence on state-preparation and output norms, improving the scaling in and compared with generic Hamiltonian-simulation-based methods. We instantiate the method for the heat equation and biharmonic diffusion under non-periodic physical boundary conditions, and we further use it as a subroutine for constant-coefficient linear parabolic surrogates arising in entropy-penalization schemes for viscous Hamilton--Jacobi equations. In the long-time regime, the same framework yields a structured quantum linear solver for with , achieving queries and improving the condition-number dependence over standard quantum linear-system algorithms in this factorized setting.
Paper Structure (31 sections, 14 theorems, 172 equations, 6 figures, 1 table)

This paper contains 31 sections, 14 theorems, 172 equations, 6 figures, 1 table.

Key Result

Lemma 2.1

Let $\mathcal{A}=\mathcal{L}^{\dagger}\mathcal{L}$ be a nonnegative self-adjoint operator independent of time. Assume that $u$ and $w$ satisfy eq:diffu u and eq:w-wave-A-LL, respectively. Let $\mathcal{H}$ be the transmutation operator in eq:Hw with kernel eq:Gaussian kernel. Then where $\Pi_1$ denotes the projection onto the first component, $\bm{\psi}_0$ and $\widetilde{\bm{f}}$ are defined in

Figures (6)

  • Figure 1: Quantum circuit for the homogeneous term.
  • Figure 2: Kernel truncation behaviour for several unitary-superposition representations. Left: truncation error $\varepsilon(R):=2\int_{R}^{\infty}\!\lvert K_i(s)\rvert\,\mathrm{d}s$ as a function of the truncation length $R$ (logarithmic scale in $\varepsilon$). Right: kernel magnitudes $\lvert K_i(s)\rvert$ on $s\in[-10,10]$ for a fixed target precision $\varepsilon=10^{-6}$ and $T=1$ .
  • Figure 3: Circuit for the normal case \ref{['eq:final_commuting_formula']}.
  • Figure : (a) Case 1: Dirichlet $u(t,0)=u(t,1)=1$.
  • Figure : (a) Case 1: Dirichlet $u(t,0)=u(t,1)=1$.
  • ...and 1 more figures

Theorems & Definitions (22)

  • Lemma 2.1
  • Theorem 3.1
  • proof
  • Theorem 4.1
  • proof
  • Corollary 4.1
  • Corollary 4.2
  • Corollary 5.1
  • proof
  • Corollary 5.2
  • ...and 12 more