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arXiv:1910.10543

An approximate description of quantum states

Marco Paini, Amir Kalev

Published Oct 23, 2019• 28 citations
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Abstract

We introduce an approximate description of an $N$-qubit state, which contains sufficient information to estimate the expectation value of any observable with precision independent of $N$. We show, in fact, that the error in the estimation of the observables' expectation values decreases as the inverse of the square root of the number of the system's identical preparations and increases, at most, linearly in a suitably defined, $N$-independent, seminorm of the observables. Building the approximate description of the $N$-qubit state only requires repetitions of single-qubit rotations followed by single-qubit measurements and can be considered for implementation on today's Noisy Intermediate-Scale Quantum (NISQ) computers. The access to the expectation values of all observables for a given state leads to an efficient variational method for the determination of the minimum eigenvalue of an observable. The method represents one example of the practical significance of the approximate description of the $N$-qubit state. We conclude by briefly discussing extensions to generative modelling and with fermionic operators.

DOI
10.48550/arxiv.1910.10543

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We introduce an approximate description of an NNN-qubit state, which contains sufficient information to estimate the expectation value of any observable with precision independent of NNN. We show, in fact, that the error in the estimation of the observables' expectation values decreases as the inverse of the square root of the number of the system's identical preparations and increases, at most, linearly in a suitably defined, NNN-independent, seminorm of the observables. Building the approximate description of the NNN-qubit state only requires repetitions of single-qubit rotations followed by single-qubit measurements and can be considered for implementation on today's Noisy Intermediate-Scale Quantum (NISQ) computers. The access to the expectation values of all observables for a given state leads to an efficient variational method for the determination of the minimum eigenvalue of an observable. The method represents one example of the practical significance of the approximate description of the NNN-qubit state. We conclude by briefly discussing extensions to generative modelling and with fermionic operators.
We introduce an approximate description of an N -qubit state, which contains sufficient information to estimate the expectation value of any observable to a precision that is upper bounded by the ratio of a suitably-defined seminorm of the observable to the square root of the number of the system's identical preparations M , with no explicit dependence on N . We describe an operational procedure for constructing the approximate description of the state that requires, besides the quantum state preparation, only single-qubit rotations followed by single-qubit measurements. We show that following this procedure, the cardinality of the resulting description of the state grows as 3MN . We test the proposed method on Rigetti's quantum processor unit with 12, 16 and 25 qubits for random states and random observables, and find an excellent agreement with the theory, despite experimental errors.
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Measuring expectation values of observables is an essential ingredient in variational quantum algorithms. A practical obstacle is the necessity of a large number of measurements for statistical convergence to meet requirements of precision, such as chemical accuracy in the application to quantum chemistry computations. Here we propose an algorithm to estimate the expectation value based on its approximate expression as a weighted sum of classically tractable matrix elements with some modulation, where the weight and modulation factors are evaluated by sampling appropriately prepared quantum states in the computational basis on quantum computers. Each of those states is prepared by applying a unitary transformation consisting of at most NNN CNOT gates, where NNN is the number of qubits, to a target quantum state whose expectation value is evaluated. Our algorithm is expected to require fewer measurements than conventional methods for a required statistical precision of the expectation value when the target quantum state is concentrated in particular computational basis states. We provide numerical comparisons of our method with existing ones for measuring electronic ground-state energies (expectation values of electronic Hamiltonians for the lowest-energy states) of various small molecules. Numerical results show that our method can reduce the numbers of measurements to obtain the ground-state energies for a targeted precision by several orders of magnitudes for molecules whose ground states are concentrated. Our results provide another route to measure expectation values of observables, which could accelerate the variational quantum algorithms.
There is growing interest in constructing quantum devices that control increasingly large numbers of quantum systems. There is a tremendous need for methods that can measure the quality and other properties of these devices. Such measurements often amount to learning the expectation value of a quantum observable with respect to the quantum state of the device. Learning expectation values is also a key component in many well-known applications such as quantum machine learning and quantum optimization algorithms. Because of the large system sizes involved, it is essential to find methods for learning expectation values that are efficient with respect to the system size. Existing methods that have rigorous guarantees and are practical to implement are often not optimal for observables of interest. Other methods are heuristic, or require the use measurement protocols that are challenging to implement experimentally with current technology. In this study, we propose an estimation procedure, The Optimal Observable expectation value Learner or TOOL, that can learn the expectation values of observables using the outcomes of any given measurement protocol. We show that there is a seminorm on the set of all observables, which we call the minimax norm, that characterizes the smallest possible estimation error for learning a given observable using the outcomes of a given non-adaptive measurement protocol to a specified confidence level in the worst case over all states. We prove that TOOL is minimax optimal for every observable by showing that it can achieve an estimation error to within a small constant factor of the minimax norm. For many applications, one wishes to learn the expectation value of more than one observable from the same experiment. A popular method for learning the expectation values of one or many observables with rigorous guarantees is classical shadows. Classical shadows has near-optimal performance in the worst case over all observables. We prove that TOOL always performs at least as well as classical shadows. Moreover, we show by example that TOOL dramatically outperforms classical shadows for many observables of interest. This highlights the need to characterize the optimal performance for the task of simultaneously learning the expectation values of many observables. Under a mild assumption, we give such a characterization using the minimax norm and prove that TOOL is nearly minimax optimal for this task. We also study the applications of TOOL to fidelity estimation. Using experimental data from a trapped-ion quantum computer, we show that TOOL performs well in practice and matches the estimates obtained from Maximum Likelihood Estimation (MLE), but with rigorous guarantees on the estimation error unlike MLE. We also compare TOOL with another popular method called direct fidelity estimation, which estimates the fidelity by judiciously sampling Pauli observables and measuring them. We show that there is a different importance sampling scheme for Pauli measurements for which TOOL performs as well as, or better than, direct fidelity estimation. Since TOOL constructs an estimator using only the observable, the measurement protocol, and the confidence level, it provides the flexibility to perform estimation for experiments that have already been performed and experiments that will be performed in the future. Similarly, since the minimax norm can be computed beforehand, it can be used to compare the performance of different measurement protocols and allow minimax optimal design of experiments.
Expectation value estimation is ubiquitous in quantum algorithms. The expectation value of a Hamiltonian, which is essential in various practical applications, is often estimated by measuring a large number of Pauli strings on quantum computers and performing classical post-processing. In the case of nnn-qubit molecular Hamiltonians in quantum chemistry calculations, it is necessary to evaluate O(n4)O(n^4)O(n4) Pauli strings, requiring a large number of measurements for accurate estimation. To reduce the measurement cost, we assess an existing idea that uses two copies of an nnn-qubit quantum state of interest and coherently measures them in the Bell basis, which enables the simultaneous estimation of the absolute values of expectation values of all the nnn-qubit Pauli strings. We numerically investigate the efficiency of energy estimation for molecular Hamiltonians of up to 12 qubits. The results show that, when the target precision is no smaller than tens of milli-Hartree, this method requires fewer measurements than conventional sampling methods. This suggests that the method may be useful for many applications that rely on expectation value estimation of Hamiltonians and other observables as well when moderate precision is sufficient.
We use a meta-learning neural-network approach to predict measurement outcomes of a quantum state in arbitrary local bases and thus carry out an approximate quantum state tomography. Each stage of this procedure can be performed efficiently, allowing it to be used effectively on large systems. We demonstrate this approach on the most recent noisy intermediate-scale IBM Quantum devices, achieving an accurate generative model for a 6-qubit state's measurement outcomes with only 100 random measurement settings as opposed to the 729 settings required for full tomography. This reduction in the required number of measurements scales favourably, with around 200 measurement settings yielding good results for a 10 qubit state that would require 59,049 settings for full quantum state tomography. This reduction in the number of measurement settings coupled with the efficiency of the procedure could allow for estimations of expectation values and state fidelities in practicable times on current quantum devices. For suitable states, this could then help in increasing the speed of other optimization schemes when attempting to produce states on noisy quantum devices at a scale where traditional maximum likelihood based approaches are impractical.