arXiv subjects

Peter J. Love

Publications and source records attributed to Peter J. Love.

At least 37 records · Page 2Linked to original sources

arXiv2025

Accurately Simulating the Time Evolution of an Ising Model with Echo Verified Clifford Data Regression on a Superconducting Quantum Computer

We present an error mitigation strategy composed of Echo Verification (EV) and Clifford Data Regression (CDR), the combination of which allows one to learn the effect of the quantum noise channel to extract error mitigated estimates for the expectation value of Pauli observables. We analyse the behaviour of the method under the depolarizing channel and derive an estimator for the depolarization rate in terms of the ancilla purity and postselection probability. We also highlight the sensitivity of this probability to noise, a potential bottleneck for the technique. We subsequently consider a more general noise channel consisting of arbitrary Pauli errors, which reveals a linear relationship between the error rates and the estimation of expectation values, suggesting the learnability of noise in EV by regression techniques. Finally, we present a practical demonstration of Echo Verified Clifford Data Regression (EVCDR) on a superconducting quantum computer and observe accurate results for the time evolution of an Ising model over spin-lattices consisting of up to 35 sites and circuit depths up to 173 entangling layers.

quant-ph↗

arXiv2024

Error mitigation, optimization, and extrapolation on a trapped ion testbed

Current noisy intermediate-scale quantum (NISQ) trapped-ion devices are subject to errors which can significantly impact the accuracy of calculations if left unchecked. A form of error mitigation called zero noise extrapolation (ZNE) can decrease an algorithm's sensitivity to these errors without increasing the number of required qubits. Here, we explore different methods for integrating this error mitigation technique into the Variational Quantum Eigensolver (VQE) algorithm for calculating the ground state of the HeH+ molecule at 0.8 Angstrom in the presence of realistic noise. Using the Quantum Scientific Computing Open User Testbed (QSCOUT) trapped-ion device, we test three methods of scaling noise for extrapolation: time-stretching the two-qubit gates, scaling the sideband amplitude parameter, and inserting two-qubit gate identity operations into the ansatz circuit. We find time-stretching and sideband amplitude scaling fail to scale the noise on our particular hardware in a way that can be directly extrapolated to zero noise. Scaling our noise with global gate identity insertions and extrapolating after variational optimization, we achieve an estimate of the ground state energy within -0.004 +- 0.04 Hartree; outside chemical accuracy, but greatly improved over our non-error-mitigated estimate with error 0.127 +- 0.008 Hartree. Our results show that the efficacy of this error mitigation technique depends on choosing the correct implementation for a given device architecture.

quant-ph↗

arXiv2024

Demonstration of a CAFQA-bootstrapped Variational Quantum Eigensolver on a Trapped-Ion Quantum Computer

To enhance the variational quantum eigensolver (VQE), the CAFQA method can utilize classical computational capabilities to identify a better initial state than the Hartree-Fock method. Previous research has demonstrated that the initial state provided by CAFQA recovers more correlation energy than that of the Hartree-Fock method and results in faster convergence. In the present study, we advance the investigation of CAFQA by demonstrating its advantages on a high-fidelity trapped-ion quantum computer located at the Duke Quantum Center -- this is the first experimental demonstration of CAFQA-bootstrapped VQE on a TI device and on any academic quantum device. In our VQE experiment, we use LiH and BeH$_2$ as test cases to show that CAFQA achieves faster convergence and obtains lower energy values within the specified computational budget limits. To ensure the seamless execution of VQE on this academic device, we develop a novel hardware-software interface framework that supports independent software environments for both the circuit and hardware end. This mechanism facilitates the automation of VQE-type job executions as well as mitigates the impact of random hardware interruptions. This framework is versatile and can be applied to a variety of academic quantum devices beyond the trapped-ion quantum computer platform, with support for integration with customized packages.

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arXiv2024

Contextual Subspace Variational Quantum Eigensolver Calculation of the Dissociation Curve of Molecular Nitrogen on a Superconducting Quantum Computer

In this work we present an experimental demonstration of the Contextual Subspace Variational Quantum Eigensolver on superconducting quantum hardware. In particular, we compute the potential energy curve for molecular nitrogen, where a dominance of static correlation in the dissociation limit proves challenging for many conventional quantum chemistry techniques. Our quantum simulations retain good agreement with the full configuration interaction energy in the chosen STO-3G basis, outperforming all benchmarked single-reference wavefunction techniques in capturing the bond-breaking appropriately. Moreover, our methodology is competitive with several multiconfigurational approaches, but at a considerable saving of quantum resource, meaning larger active spaces can be treated for a fixed qubit allowance. To achieve this result we deploy an error mitigation/suppression strategy comprised of dynamical decoupling, measurement-error mitigation and zero-noise extrapolation, in addition to circuit parallelization that not only provides passive averaging of noise but improves the effective shot-yield to reduce the measurement overhead. Furthermore, we introduce a modification to previous adaptive ansatz construction algorithms that incorporates hardware-awareness into our variational circuits to minimize the transpilation cost for the target qubit topology.

quant-ph↗

arXiv2023

Simulating Scattering of Composite Particles

We develop a non-perturbative approach to simulating scattering on classical and quantum computers, in which the initial and final states contain a fixed number of composite particles. The construction is designed to mimic a particle collision, wherein two composite particles are brought in contact. The initial states are assembled via consecutive application of operators creating eigenstates of the interacting theory from vacuum. These operators are defined with the aid of the Møller wave operator, which can be constructed using such methods as adiabatic state preparation or double commutator flow equation. The approach is well-suited for studying strongly coupled systems in both relativistic and non-relativistic settings. For relativistic systems, we employ the language of light-front quantization, which has been previously used for studying the properties of individual bound states, as well as for simulating their scattering in external fields, and is now adopted to the studies of scattering of bound state systems. For simulations on classical computers, we describe an algorithm for calculating exact (in the sense of a given discretized theory) scattering probabilities, which has cost (memory and time) exponential in momentum grid size. Such calculations may be interesting in their own right and can be used for benchmarking results of a quantum simulation algorithm, which is the main application of the developed framework. We illustrate our ideas with an application to the $ϕ^4$ theory in $1+1\rm D$.

quant-ph↗

arXiv2023

CAFQA: A classical simulation bootstrap for variational quantum algorithms

This work tackles the problem of finding a good ansatz initialization for Variational Quantum Algorithms (VQAs), by proposing CAFQA, a Clifford Ansatz For Quantum Accuracy. The CAFQA ansatz is a hardware-efficient circuit built with only Clifford gates. In this ansatz, the parameters for the tunable gates are chosen by searching efficiently through the Clifford parameter space via classical simulation. The resulting initial states always equal or outperform traditional classical initialization (e.g., Hartree-Fock), and enable high-accuracy VQA estimations. CAFQA is well-suited to classical computation because: a) Clifford-only quantum circuits can be exactly simulated classically in polynomial time, and b) the discrete Clifford space is searched efficiently via Bayesian Optimization. For the Variational Quantum Eigensolver (VQE) task of molecular ground state energy estimation (up to 18 qubits), CAFQA's Clifford Ansatz achieves a mean accuracy of nearly 99% and recovers as much as 99.99% of the molecular correlation energy that is lost in Hartree-Fock initialization. CAFQA achieves mean accuracy improvements of 6.4x and 56.8x, over the state-of-the-art, on different metrics. The scalability of the approach allows for preliminary ground state energy estimation of the challenging chromium dimer (Cr$_2$) molecule. With CAFQA's high-accuracy initialization, the convergence of VQAs is shown to accelerate by 2.5x, even for small molecules. Furthermore, preliminary exploration of allowing a limited number of non-Clifford (T) gates in the CAFQA framework, shows that as much as 99.9% of the correlation energy can be recovered at bond lengths for which Clifford-only CAFQA accuracy is relatively limited, while remaining classically simulable.

quant-ph↗

arXiv2023

Benchmarking Noisy Intermediate Scale Quantum Error Mitigation Strategies for Ground State Preparation of the HCl Molecule

Due to numerous limitations including restrictive qubit topologies, short coherence times and prohibitively high noise floors, few quantum chemistry experiments performed on existing noisy intermediate-scale quantum hardware have achieved the high bar of chemical precision, namely energy errors to within 1.6 mHa of full configuration interaction. To have any hope of doing so, we must layer contemporary resource reduction techniques with best-in-class error mitigation methods; in particular, we combine the techniques of qubit tapering and the contextual subspace variational quantum eigensolver with several error mitigation strategies comprised of measurement-error mitigation, symmetry verification, zero-noise extrapolation and dual-state purification. We benchmark these strategies across a suite of eight 27-qubit IBM Falcon series quantum processors, taking preparation of the HCl molecule's ground state as our testbed.

quant-ph↗

arXiv2023

Unitary Partitioning and the Contextual Subspace Variational Quantum Eigensolver

The contextual subspace variational quantum eigensolver (CS-VQE) is a hybrid quantum-classical algorithm that approximates the ground-state energy of a given qubit Hamiltonian. It achieves this by separating the Hamiltonian into contextual and noncontextual parts. The ground-state energy is approximated by classically solving the noncontextual problem, followed by solving the contextual problem using VQE, constrained by the noncontextual solution. In general, computation of the contextual correction needs fewer qubits and measurements compared with solving the full Hamiltonian via traditional VQE. We simulate CS-VQE on different tapered molecular Hamiltonians and apply the unitary partitioning measurement reduction strategy to further reduce the number of measurements required to obtain the contextual correction. Our results indicate that CS-VQE combined with measurement reduction is a promising approach to allow feasible eigenvalue computations on noisy intermediate-scale quantum devices. We also provide a modification to the CS-VQE algorithm; the CS-VQE algorithm previously could cause an exponential increase in Hamiltonian terms, but with this modification now at worst will scale quadratically.

quant-ph↗

arXiv2022

A stabilizer framework for Contextual Subspace VQE and the noncontextual projection ansatz

Quantum chemistry is a promising application for noisy intermediate-scale quantum (NISQ) devices. However, quantum computers have thus far not succeeded in providing solutions to problems of real scientific significance, with algorithmic advances being necessary to fully utilise even the modest NISQ machines available today. We discuss a method of ground state energy estimation predicated on a partitioning the molecular Hamiltonian into two parts: one that is noncontextual and can be solved classically, supplemented by a contextual component that yields quantum corrections obtained via a Variational Quantum Eigensolver (VQE) routine. This approach has been termed Contextual Subspace VQE (CS-VQE), but there are obstacles to overcome before it can be deployed on NISQ devices. The problem we address here is that of the ansatz - a parametrized quantum state over which we optimize during VQE. It is not initially clear how a splitting of the Hamiltonian should be reflected in our CS-VQE ansätze. We propose a 'noncontextual projection' approach that is illuminated by a reformulation of CS-VQE in the stabilizer formalism. This defines an ansatz restriction from the full electronic structure problem to the contextual subspace and facilitates an implementation of CS-VQE that may be deployed on NISQ devices. We validate the noncontextual projection ansatz using a quantum simulator, with results obtained herein for a suite of trial molecules.

quant-ph↗

arXiv2022

Quantum Simulation of Second-Quantized Hamiltonians in Compact Encoding

We describe methods for simulating general second-quantized Hamiltonians using the compact encoding, in which qubit states encode only the occupied modes in physical occupation number basis states. These methods apply to second-quantized Hamiltonians composed of a constant number of interactions, i.e., linear combinations of ladder operator monomials of fixed form. Compact encoding leads to qubit requirements that are optimal up to logarithmic factors. We show how to use sparse Hamiltonian simulation methods for second-quantized Hamiltonians in compact encoding, give explicit implementations for the required oracles, and analyze the methods. We also describe several example applications including the free boson and fermion theories, the $ϕ^4$-theory, and the massive Yukawa model, all in both equal-time and light-front quantization. Our methods provide a general-purpose tool for simulating second-quantized Hamiltonians, with optimal or near-optimal scaling with error and model parameters.

quant-ph↗

arXiv2022

Quantum and Classical Bayesian Agents

We describe a general approach to modeling rational decision-making agents who adopt either quantum or classical mechanics based on the Quantum Bayesian (QBist) approach to quantum theory. With the additional ingredient of a scheme by which the properties of one agent may influence another, we arrive at a flexible framework for treating multiple interacting quantum and classical Bayesian agents. We present simulations in several settings to illustrate our construction: quantum and classical agents receiving signals from an exogenous source, two interacting classical agents, two interacting quantum agents, and interactions between classical and quantum agents. A consistent treatment of multiple interacting users of quantum theory may allow us to properly interpret existing multi-agent protocols and could suggest new approaches in other areas such as quantum algorithm design.

quant-ph↗

arXiv2022

Limitations of Local Quantum Algorithms on Random Max-k-XOR and Beyond

We introduce a notion of \emph{generic local algorithm} which strictly generalizes existing frameworks of local algorithms such as \emph{factors of i.i.d.} by capturing local \emph{quantum} algorithms such as the Quantum Approximate Optimization Algorithm (QAOA). Motivated by a question of Farhi et al. [arXiv:1910.08187, 2019] we then show limitations of generic local algorithms including QAOA on random instances of constraint satisfaction problems (CSPs). Specifically, we show that any generic local algorithm whose assignment to a vertex depends only on a local neighborhood with $o(n)$ other vertices (such as the QAOA at depth less than $ε\log(n)$) cannot arbitrarily-well approximate boolean CSPs if the problem satisfies a geometric property from statistical physics called the coupled overlap-gap property (OGP) [Chen et al., Annals of Probability, 47(3), 2019]. We show that the random MAX-k-XOR problem has this property when $k\geq4$ is even by extending the corresponding result for diluted $k$-spin glasses. Our concentration lemmas confirm a conjecture of Brandao et al. [arXiv:1812.04170, 2018] asserting that the landscape independence of QAOA extends to logarithmic depth -- in other words, for every fixed choice of QAOA angle parameters, the algorithm at logarithmic depth performs almost equally well on almost all instances. One of these concentration lemmas is a strengthening of McDiarmid's inequality, applicable when the random variables have a highly biased distribution, and may be of independent interest.

quant-ph↗

arXiv2022

Counterdiabaticity and the quantum approximate optimization algorithm

The quantum approximate optimization algorithm (QAOA) is a near-term hybrid algorithm intended to solve combinatorial optimization problems, such as MaxCut. QAOA can be made to mimic an adiabatic schedule, and in the $p\to\infty$ limit the final state is an exact maximal eigenstate in accordance with the adiabatic theorem. In this work, the connection between QAOA and adiabaticity is made explicit by inspecting the regime of $p$ large but finite. By connecting QAOA to counterdiabatic (CD) evolution, we construct CD-QAOA angles which mimic a counterdiabatic schedule by matching Trotter "error" terms to approximate adiabatic gauge potentials which suppress diabatic excitations arising from finite ramp speed. In our construction, these "error" terms are helpful, not detrimental, to QAOA. Using this matching to link QAOA with quantum adiabatic algorithms (QAA), we show that the approximation ratio converges to one at least as $1-C(p)\sim 1/p^μ$. We show that transfer of parameters between graphs, and interpolating angles for $p+1$ given $p$ are both natural byproducts of CD-QAOA matching. Optimization of CD-QAOA angles is equivalent to optimizing a continuous adiabatic schedule. Finally, we show that, using a property of variational adiabatic gauge potentials, QAOA is at least counterdiabatic, not just adiabatic, and has better performance than finite time adiabatic evolution. We demonstrate the method on three examples: a 2 level system, an Ising chain, and the MaxCut problem.

quant-ph↗

arXiv2021

Lipkin model on a quantum computer

Atomic nuclei are important laboratories for exploring and testing new insights into the universe, such as experiments to directly detect dark matter or explore properties of neutrinos. The targets of interest are often heavy, complex nuclei that challenge our ability to reliably model them (as well as quantify the uncertainty of those models) with classical computers. Hence there is great interest in applying quantum computation to nuclear structure for these applications. As an early step in this direction, especially with regards to the uncertainties in the relevant quantum calculations, we develop circuits to implement variational quantum eigensolver (VQE) algorithms for the Lipkin-Meshkov-Glick model, which is often used in the nuclear physics community as a testbed for many-body methods. We present quantum circuits for VQE for two and three particles and discuss the construction of circuits for more particles. Implementing the VQE for a two-particle system on the IBM Quantum Experience, we identify initialization and two-qubit gates as the largest sources of error. We find that error mitigation procedures reduce the errors in the results significantly, but additional quantum hardware improvements are needed for quantum calculations to be sufficiently accurate to be competitive with the best current classical methods.

hep-th↗

arXiv2021

Variational quantum eigensolvers for sparse Hamiltonians

Hybrid quantum-classical variational algorithms such as the variational quantum eigensolver (VQE) and the quantum approximate optimization algorithm (QAOA) are promising applications for noisy, intermediate-scale quantum (NISQ) computers. Both VQE and QAOA variationally extremize the expectation value of a Hamiltonian. All work to date on VQE and QAOA has been limited to Pauli representations of Hamiltonians. However, many cases exist in which a sparse representation of the Hamiltonian is known but there is no efficient Pauli representation. We extend VQE to general sparse Hamiltonians. We provide a decomposition of a fermionic second-quantized Hamiltonian into a number of one-sparse, self-inverse, Hermitian terms linear in the number of ladder operator monomials in the second-quantized representation. We provide a decomposition of a general $d$-sparse Hamiltonian into $O(d^2)$ such terms. In both cases a single sample of any term can be obtained using two ansatz state preparations and at most six oracle queries. The number of samples required to estimate the expectation value to precision $ε$ scales as $ε^{-2}$ as for Pauli-based VQE. This widens the domain of applicability of VQE to systems whose Hamiltonian and other observables are most efficiently described in terms of sparse matrices.

quant-ph↗

arXiv2021

Benchmarking near-term quantum devices with the Variational Quantum Eigensolver and the Lipkin-Meshkov-Glick model

The Variational Quantum Eigensolver (VQE) is a promising algorithm for Noisy Intermediate Scale Quantum (NISQ) computation. Verification and validation of NISQ algorithms' performance on NISQ devices is an important task. We consider the exactly-diagonalizable Lipkin-Meshkov-Glick (LMG) model as a candidate for benchmarking NISQ computers. We use the Bethe ansatz to construct eigenstates of the trigonometric LMG model using quantum circuits inspired by the LMG's underlying algebraic structure. We construct circuits with depth $\mathcal{O}(N)$ and $\mathcal{O}(\log_2N)$ that can prepare any trigonometric LMG eigenstate of $N$ particles. The number of gates required for both circuits is $\mathcal{O}(N)$. The energies of the eigenstates can then be measured and compared to the exactly-known answers.

quant-ph↗

arXiv2021

Contextual Subspace Variational Quantum Eigensolver

We describe the contextual subspace variational quantum eigensolver (CS-VQE), a hybrid quantum-classical algorithm for approximating the ground state energy of a Hamiltonian. The approximation to the ground state energy is obtained as the sum of two contributions. The first contribution comes from a noncontextual approximation to the Hamiltonian, and is computed classically. The second contribution is obtained by using the variational quantum eigensolver (VQE) technique to compute a contextual correction on a quantum processor. In general the VQE computation of the contextual correction uses fewer qubits and measurements than the VQE computation of the original problem. Varying the number of qubits used for the contextual correction adjusts the quality of the approximation. We simulate CS-VQE on tapered Hamiltonians for small molecules, and find that the number of qubits required to reach chemical accuracy can be reduced by more than a factor of two. The number of terms required to compute the contextual correction can be reduced by more than a factor of ten, without the use of other measurement reduction schemes. This indicates that CS-VQE is a promising approach for eigenvalue computations on noisy intermediate-scale quantum devices.

quant-ph↗

arXiv2021

MAXCUT QAOA performance guarantees for p >1

We obtain worst case performance guarantees for $p=2$ and $3$ QAOA for MAXCUT on uniform 3-regular graphs. Previous work by Farhi et al obtained a lower bound on the approximation ratio of $0.692$ for $p=1$. We find a lower bound of $0.7559$ for $p=2$, where worst case graphs are those with no cycles $\leq 5$. This bound holds for any 3 regular graph evaluated at particular fixed parameters. We conjecture a hierarchy for all $p$, where worst case graphs have with no cycles $\leq 2p+1$. Under this conjecture, the approximation ratio is at least $0.7924$ for all 3 regular graphs and $p=3$. In addition, using a simple indistinguishability argument we find an upper bound on the worst case approximation ratio for all $p$, which indicates classes of graphs for which there can be no quantum advantage for at least $p<6$.

quant-ph↗