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The Journal of Physical Chemistry Letters

Variational Quantum Simulation of Lindblad Dynamics via Quantum State Diffusion

Jianming Luo, Kaihan Lin, Xing Bao Gao

Published Mar 22, 2024• 21 citations
Publisher

Abstract

Quantum simulation of dynamics in open quantum systems is crucial but poses a significant challenge due to the non-Hermitian nature leading to nonunitary evolution and the limited quantum resources on current quantum computers. Here we introduce a variational hybrid quantum-classical algorithm designed for simulating the time evolution governed by the Lindblad master equation. Our approach involves on a stochastic unveiling of the density matrix, transforming the Lindblad equation into a wave function-based quantum state diffusion (QSD) method with the aim of reducing qubit requirements. We then apply variational quantum simulation (VQS) to efficiently capture the nonunitary evolution in QSD. We demonstrate our QSD-VQS algorithm by investigating the quantum dynamics in a two-level system subjected to an amplitude damping channel and a four-level transverse field Ising model within a dissipative environment including time-independent and periodic Hamiltonian cases. The results reveal its promising utility with upcoming hardware in the near future.

DOI
10.1021/acs.jpclett.4c00576

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Quantum simulation of dynamics in open quantum systems is crucial but poses a significant challenge due to the non-Hermitian nature leading to nonunitary evolution and the limited quantum resources on current quantum computers. Here we introduce a variational hybrid quantum-classical algorithm designed for simulating the time evolution governed by the Lindblad master equation. Our approach involves on a stochastic unveiling of the density matrix, transforming the Lindblad equation into a wave function-based quantum state diffusion (QSD) method with the aim of reducing qubit requirements. We then apply variational quantum simulation (VQS) to efficiently capture the nonunitary evolution in QSD. We demonstrate our QSD-VQS algorithm by investigating the quantum dynamics in a two-level system subjected to an amplitude damping channel and a four-level transverse field Ising model within a dissipative environment including time-independent and periodic Hamiltonian cases. The results reveal its promising utility with upcoming hardware in the near future.
We investigate dynamical quantum phase transitions (DQPTs) in Markovian open quantum systems using a variational quantum simulation (VQS) algorithm based on quantum state diffusion (QSD). This approach reformulates the Lindblad master equation as an ensemble of pure-state trajectories, enabling efficient simulation of dissipative quantum dynamics with effectively reduced quantum resources. Focusing on the one-dimensional transverse-field Ising model (TFIM), we simulate quench dynamics under both local and global Lindblad dissipation. The QSD-VQS algorithm accurately captures the nonanalytic cusps in the Loschmidt rate function, and reveals their modulation by dissipation strength and system size. Notably, DQPTs are gradually suppressed under strong local dissipation, while they persist under strong global dissipation due to collective environmental effects. Benchmarking against exact Lindblad solutions confirms the high accuracy and scalability of our method.
Quantum simulation of non-Markovian open quantum dynamics is essential but challenging for standard quantum computers due to their non-Hermitian nature, leading to non-unitary evolution, and the limitations of available quantum resources. Here we introduce a hybrid quantum-classical algorithm designed for simulating dissipative dynamics in system with non-Markovian environment. Our approach includes formulating a non-Markovian Stochastic Schrödinger equation with complex frequency modes (cNMSSE) where the non-Markovianity is characterized by the mode excitation. Following this, we utilize variational quantum simulation to capture the non-unitary evolution within the cNMSSE framework, leading to a substantial reduction in qubit requirements. To demonstrate our approach, we investigated the spin-boson model and dynamic quantum phase transitions (DQPT) within transverse field Ising model (TFIM). Significantly, our findings reveal the enhanced DQPT in TFIM due to non-Markovian behavior.
Simulating non-Markovian open quantum dynamics is crucial for understanding complex quantum systems, yet it poses significant challenges for standard quantum hardware. These challenges stem from the non-Hermitian nature of such dynamics, which results in nonunitary evolution, as well as constraints imposed by limited quantum resources. To address this, we propose a hybrid quantum-classical algorithm designed for simulating dissipative dynamics in systems coupled to non-Markovian environments. Our approach includes formulating a non-Markovian Stochastic Schrödinger equation with complex frequency modes (cNMSSE) where the non-Markovianity is characterized by the mode excitation. We then employ variational quantum simulation to capture the nonunitary evolution within the cNMSSE framework, leading to a substantial reduction in qubit requirements. To demonstrate our approach, we investigated dissiaptive dynamics in the spin-boson model (SBM) and excitation energy transfer processes in both a prototype dimer system and the biologically relevant Fenna-Matthews-Olson (FMO) complex.
Abstract We introduce variational hybrid classical-quantum algorithms to simulate the Lindblad master equation and its adjoint for time-evolving Markovian open quantum systems and quantum observables. Our methods are based on a direct representation of density matrices and quantum observables as quantum superstates. We design and optimize low-depth variational quantum circuits that efficiently capture the unitary and non-unitary dynamics of the solutions. We benchmark and test the algorithms on different models and system sizes, showing their potential for utility with near-future hardware.
The simulation of many-body open quantum systems is key to solving numerous outstanding problems in physics, chemistry, material science, and in the development of quantum technologies. Near-term quantum computers may bring considerable advantage for the efficient simulation of their static and dynamical properties, thanks to hybrid quantum-classical variational algorithms to approximate the dynamics of the density matrix describing the quantum state in terms of an ensemble average. Here, a variational quantum algorithm is developed to simulate the real-time evolution of the density matrix governed by the Lindblad master equation, under the assumption that the quantum state has a bounded entropy along the dynamics, entailing a low-rank representation of its density matrix. The algorithm encodes each pure state of the statistical mixture as a parametrized quantum circuit, and the associated probabilities as additional variational parameters stored classically, thereby requiring a significantly lower number of qubits than algorithms where the full density matrix is encoded in the quantum memory. Two variational ansatze are proposed, and their effectiveness is assessed in the simulation of the dynamics of a 2D dissipative transverse field Ising model. The results underscore the algorithm's efficiency in simulating the dynamics of open quantum systems in the low-rank regime with limited quantum resources on a near-term quantum device.
Accurate simulation of the time evolution of a quantum system under the influence of an environment is critical to making accurate predictions in chemistry, condensed-matter physics, and materials sciences. Whereas there has been a recent surge in interest in quantum algorithms for the prediction of nonunitary time evolution in quantum systems, few studies offer a direct quantum analog to the Lindblad equation. Here, we present a quantum algorithm---utilizing a decomposition of nonunitary operators approach---that models dynamic processes via the unraveled Lindblad equation. This algorithm is employed to probe both a two-level system in an amplitude damping channel as well as the transverse field Ising model in a variety of parameter regimes; the resulting population dynamics demonstrate excellent agreement with classical simulation, showing the promise of predicting population dynamics utilizing quantum devices for a variety of important systems in molecular energy transport, quantum optics, and other open quantum systems.