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High-Fidelity Control of Spin Ensemble Dynamics via Artificial Intelligence: From Quantum Computing to Imaging

V. S. Manu, KowsalyaDevi Pavuluri, Michael Mullen, Michael Garwood, Gianluigi Veglia

Published Apr 20, 2021• 1 citation
Publisher

Abstract

Abstract High-fidelity control of spin ensemble dynamics is essential to many fields, spanning from quantum computing to optical, coherent, and nuclear magnetic resonance (NMR) spectroscopy and imaging (MRI). However, attaining robust and high-fidelity quantum spin operations remains an unmet challenge. Using a combination of an evolutionary algorithm and artificial intelligence, we designed time-optimal, radio frequency (RF) pulses with tunable spatial or temporal field inhomogeneity compensation and fidelity for unitary operations up to 0.9999. As a benchmark, we constructed a spin entanglement operator and a programmable quantum state creator for a weakly-coupled two-spin-1/2 system. We achieved high-fidelity transformations under multiple inhomogeneity sources. The newly designed RF pulses are more robust and less prone to imperfection than the commonly used shapes for basic liquid-state NMR experiments and reduce RF artifacts in MRI. This new strategy will enable the design of efficient quantum computing opera-tors as well as new spectroscopic and imaging techniques.

DOI
10.21203/rs.3.rs-403351/v1

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Working on quantum systems entail different interests, for example, working on fundamental \nunderstanding of quantum systems also lay foundation for better quantum computation \ntechniques. A test for whether a system is behaving quantum mechanically or \nclassically is devised by Leggett and Garg in form of inequalities, called Leggett-Garg Inequalities \n(LGI). Such Inequalities are violated by a system whose evolution is governed \nby quantum mechanics. A precise experiment to violate LGIs require a guarantee that the \nmeasurement does not affect the system or its future dynamics. These Inequalities were \nproposed for dichotomic systems,systems which can have two outcomes. Here we present \nan LG experiment on a three-level quantum system, which theoretically have larger quantum \nupper bound than that of a two-level quantum system. This larger violation also \nprovides a bigger buffer to taking in account of the various experimental imperfections. \nPerforming a quantum computing task requires precise level of control to initialize, \nperform and measure the quantum system. With increasing size of the quantum processor \nthe challenge is to maintain optimal control. Nuclear Magnetic Resonance (NMR) has \nalways been a very faithful test-bed for quantum processing ideas. In NMR, we perform \nRadio Frequency (RF) pulses to control and steer the system to the desired state. Most \nused method to derive the exact frequency and amplitude of these pulses for a given \ntask is based on gradient. Although systematic, one have to simulate these pulses on \na classical computer first, which makes the task very inefficient. We report a a way of \nperforming optimization with a hybrid quantum-classical scheme. This scheme helps us \nperform classically harder computational tasks on the quantum processor. We optimize \npulses which drive our system from 7-coherence state to 12-coherence state on a 12-qubit \nNMR processor. \nElectron Spin Resonance (ESR) employs the same techniques as of NMR but having \nadvantage in larger polarization compared to later. Although this does not imply better \ncontrol, cause the frequency at which pulses are required to control an ESR system fall into \nmicrowave region. Microwave frequency are harder to control electronically, thus making \nit harder for performing ESR quantum computing. The hybrid scheme used in NMR \nexperiment relies on some ideal pulses which are needed to be optimized classically. We \nalleviate this requirement by using finite difference method of calculating gradient. We \ncompare these methods with the earlier methods to show the superiority of such a scheme. \nState-to-state transfer pulses are sufficient for most of the quantum computing task, \nbut, an universal quantum information implementation requires state independent pulses. \nThe techniques used in optimizing state-to-state pulses can be modified to optimize for a \nstate independent pulse. We show that this methods scale polynomially with the number \nof qubits and is general in terms of its implementation. We further reduce the resource \nrequirement by using a NMR related implementation.

•Jul 11, 2019•0 citations
Abstract High-fidelity control of spin ensemble dynamics is essential to many fields, spanning from quantum computing to optical, coherent, and nuclear magnetic resonance (NMR) spectroscopy and imaging (MRI). However, attaining robust and high-fidelity quantum spin operations remains an unmet challenge. Using a combination of an evolutionary algorithm and artificial intelligence, we designed time-optimal, radio frequency (RF) pulses with tunable spatial or temporal field inhomogeneity compensation and fidelity for unitary operations up to 0.9999. As a benchmark, we constructed a spin entanglement operator and a programmable quantum state creator for a weakly-coupled two-spin-1/2 system. We achieved high-fidelity transformations under multiple inhomogeneity sources. The newly designed RF pulses are more robust and less prone to imperfection than the commonly used shapes for basic liquid-state NMR experiments and reduce RF artifacts in MRI. This new strategy will enable the design of efficient quantum computing opera-tors as well as new spectroscopic and imaging techniques.
Abstract High-fidelity control of spin ensemble dynamics is essential for many research areas, spanning from quantum computing and radio-frequency (RF) engineering to NMR spectroscopy and imaging. However, attaining robust and high-fidelity spin operations remains an unmet challenge. Using an evolutionary algorithm and artificial intelligence (AI), we designed new RF pulses with customizable spatial or temporal field inhomogeneity compensation. Compared with the standard RF shapes, the new AI-generated pulses show superior performance for bandwidth, robustness, and tolerance to field imperfections. As a benchmark, we constructed a spin entanglement operator for the weakly coupled two-spin-1/2 system of 13CHCl3, achieving high-fidelity transformations under multiple inhomogeneity sources. We then generated band-selective and ultra-broadband RF pulses typical of biomolecular NMR spectroscopy. When implemented in multipulse NMR experiments, the AI-generated pulses significantly increased the sensitivity of medium-size and large protein spectra relative to standard pulse sequences. Finally, we applied the new pulses to typical imaging experiments, showing a remarkable tolerance to changes in the RF field. These AI-generated RF pulses can be directly implemented in quantum information, NMR spectroscopy of biomolecules, magnetic resonance imaging techniques for in vivo and materials sciences.
With the development of quantum information science, the active manipulation of quantum systems is becoming an important research frontier. To build realistic quantum information processors, one of the challenges is to implement arbitrary desired operations with high precision on quantum systems. A large number of quantum control methods and relevant numerical techniques have been put forward in recent years, such as quantum optimal control and quantum feedback control. Nuclear magnetic resonance (NMR) spin systems offer an excellent testbed to develop benchmark tools and techniques for controlling quantum systems. In this review paper, we briefly introduce some of the basic control ideas developed for NMR systems in recent years. We first explain, for the liquid spin systems, the physics of various couplings and the causes of relaxation effects. These mechanisms govern the system dynamics, and thus are crucial for constructing rigorous and efficient control models. We also identify three types of available control means: 1) raido-frequency fields as coherent controls; 2) phase cycling, gradient fields and relaxation effects as non-unitary controls; 3) radiation damping effect as feedback control mechanism. Then, we elucidate some important control tasks, which may arise from the conventional NMR spectroscopy (e.g., pulse design and polarization transfer) or from quantum information science (e.g., algorithmic cooling and pseudo-pure state preparation). In the last part, we review some of the most important control methods that are applicable to NMR control tasks. For systems with a relatively small number of spins, it is possible to use analytic optimal control theory to realize the target unitary operations. However, for larger systems, numerical methods are necessary. The gradient ascent pulse engineering algorithm and pulse compiler techniques are the most successful techniques for implementing complicated quantum networks currently. There are some interesting topics of utilizing radiation damping and relaxation effects to achieve more powerful controls. Finally, we give an outline of the possible future work.
An exquisite control over the dynamics of a quantum system is essential for realizing any quantum technology. This thesis presents some practical and efficient strategies for coherent quantum control: a paradigm for controlling quantum dynamics using electromagnetic fields. Coherent control is a common framework for describing the physical implementation of quantum logic gates in several quantum information processing platforms including superconducting qubits and trapped ions. For the purpose of demonstration, however, liquid-state Nuclear Magnetic Resonance (NMR) is used in this thesis as it is an ideal test-bed for developing, testing and benchmarking coherent control tools and techniques. Coherent control was revitalised in 2005 by the development of Gradient Ascent Pulse Engineering (GRAPE), a powerful optimal control technique that is widely used for designing shaped pulses for a variety of tasks. GRAPE, like any other closed-loop optimal control algorithm, requires multiple evaluations of the computationally expensive matrix exponential and the full time-evolution propagator. To this end, I present strategies to sidestep the explicit evaluation of matrix exponentials, thereby offering substantial speed-ups over conventional implementations of the GRAPE algorithm. The results are demonstrated experimentally in NMR, but also in simulations of ultracold molecules and superconducting qubits. Beyond GRAPE, this thesis also considers methods for designing spin-echo sequences for implementing any arbitrary network of controlled-Z gates in a system of qubits with zz-couplings. First, a method based on linear-programming provides near time-optimal sequences in fully-coupled systems having up to a few hundred qubits. Further, an analytic method based on graph colouring finds near time-optimal spin echo sequences in engineered systems with any number of qubits having only nearest and next-nearest neighbour-couplings.
We propose a new approach to the measurement of a single spin state, based on nuclear magnetic resonance (NMR) techniques and inspired by the coherent control over many-body systems envisaged by quantum information processing. A single target spin is coupled via the magnetic dipolar interaction to a large ensemble of spins. Applying radio frequency pulses, we can control the evolution so that the spin ensemble reaches one of two orthogonal states whose collective properties differ depending on the state of the target spin and are easily measured. We first describe this measurement process using quantum gates; then we show how equivalent schemes can be defined in terms of the Hamiltonian and thus implemented under conditions of real control, using well established NMR techniques. We demonstrate this method with a proof of principle experiment in ensemble liquid state NMR and simulations for small spin systems.
Nuclear magnetic resonance (NMR) spectroscopy has proven to be a facile means of achieving small-scale demonstrations of quantum information processing. This was in large part made possible by the sophisticated methods of quantum control that have been developed by the NMR community over a span of more than 50 years. The traditional control methods, already perhaps the most complex examples of open-loop control available, were nevertheless designed primarily to assist in identifying the physical parameters of the underlying spin system, rather than to control the system with high precision. We have therefore extended the traditional methods in a variety of ways so as to achieve precise control, by taking advantage of prior knowledge of the physical parameters as determined by traditional methods. Due to the experimental challenges of real-time control, these developments relied upon our ability to simulate the evolution of the system under the action of radio-frequency control fields with essentially arbitrary precision, subject only to the available computing power. This talk presents an overview of our work in quantum control together with some of the on-going challenges still facing us
Working on quantum systems entail different interests, for example, working on fundamental \nunderstanding of quantum systems also lay foundation for better quantum computation \ntechniques. A test for whether a system is behaving quantum mechanically or \nclassically is devised by Leggett and Garg in form of inequalities, called Leggett-Garg Inequalities \n(LGI). Such Inequalities are violated by a system whose evolution is governed \nby quantum mechanics. A precise experiment to violate LGIs require a guarantee that the \nmeasurement does not affect the system or its future dynamics. These Inequalities were \nproposed for dichotomic systems,systems which can have two outcomes. Here we present \nan LG experiment on a three-level quantum system, which theoretically have larger quantum \nupper bound than that of a two-level quantum system. This larger violation also \nprovides a bigger buffer to taking in account of the various experimental imperfections. \nPerforming a quantum computing task requires precise level of control to initialize, \nperform and measure the quantum system. With increasing size of the quantum processor \nthe challenge is to maintain optimal control. Nuclear Magnetic Resonance (NMR) has \nalways been a very faithful test-bed for quantum processing ideas. In NMR, we perform \nRadio Frequency (RF) pulses to control and steer the system to the desired state. Most \nused method to derive the exact frequency and amplitude of these pulses for a given \ntask is based on gradient. Although systematic, one have to simulate these pulses on \na classical computer first, which makes the task very inefficient. We report a a way of \nperforming optimization with a hybrid quantum-classical scheme. This scheme helps us \nperform classically harder computational tasks on the quantum processor. We optimize \npulses which drive our system from 7-coherence state to 12-coherence state on a 12-qubit \nNMR processor. \nElectron Spin Resonance (ESR) employs the same techniques as of NMR but having \nadvantage in larger polarization compared to later. Although this does not imply better \ncontrol, cause the frequency at which pulses are required to control an ESR system fall into \nmicrowave region. Microwave frequency are harder to control electronically, thus making \nit harder for performing ESR quantum computing. The hybrid scheme used in NMR \nexperiment relies on some ideal pulses which are needed to be optimized classically. We \nalleviate this requirement by using finite difference method of calculating gradient. We \ncompare these methods with the earlier methods to show the superiority of such a scheme. \nState-to-state transfer pulses are sufficient for most of the quantum computing task, \nbut, an universal quantum information implementation requires state independent pulses. \nThe techniques used in optimizing state-to-state pulses can be modified to optimize for a \nstate independent pulse. We show that this methods scale polynomially with the number \nof qubits and is general in terms of its implementation. We further reduce the resource \nrequirement by using a NMR related implementation.