# Neural Error Mitigation of Near-Term Quantum Simulations

By Elizabeth R. Bennewitz, Florian Hopfmueller, Bohdan Kulchytskyy, Juan Carrasquilla, & Pooya Ronagh
One of the promising applications of early quantum computers is the simulation of quantum systems. Variational methods for near-term quantum computers, such as the variational quantum eigensolver (VQE), are a promising approach to finding ground states of quantum systems relevant in physics, chemistry, and materials science. These approaches, however, are constrained by the effects of noise as well as the limited quantum resources of near-term quantum hardware, motivating the need for quantum error mitigation techniques to reduce the effects of noise. Here we introduce $neural\:error\:mitigation$, a novel method that uses neural networks to improve estimates of ground states and ground-state observables obtained using VQE on near-term quantum computers. To demonstrate our method’s versatility, we apply neural error mitigation to finding the ground states of H2 and LiH molecular Hamiltonians, as well as the lattice Schwinger model. Our results show that neural error mitigation improves the numerical and experimental VQE computation to yield low-energy errors, low infidelities, and accurate estimations of more-complex observables like order parameters and entanglement entropy, without requiring additional quantum resources. Additionally, neural error mitigation is agnostic to both the quantum hardware and the particular noise channel, making it a versatile tool for quantum simulation. Applying quantum many-body machine learning techniques to error mitigation, our method is a promising strategy for extending the reach of near-term quantum computers to solve complex quantum simulation problems.

## Benchmark Study of Quantum Algorithms for Combinatorial Optimization: Unitary versus Dissipative

By Krishanu Sankar, Artur Scherer, Satoshi Kako, Sam Reifenstein, Navid Ghadermarzy, Willem B. Krayenhoff, Yoshitaka Inui, Edwin Ng, Tatsuhiro Onodera, Pooya Ronagh, & Yoshihisa Yamamoto

We study the performance scaling of three quantum algorithms for combinatorial optimization: measurement-feedback coherent Ising machines (MFB-CIM), discrete adiabatic quantum computation (DAQC), and the Dürr-Hoyer algorithm for quantum minimum finding (DH-QMF) that is based on Grover’s search. We use MaxCut problems as our reference for comparison, and time-to-solution (TTS) as a practical measure of performance for these optimization algorithms…

## Scaling Up Electronic Structure Calculations on Quantum Computers: The Frozen Natural Orbital Based Method of Increments

By Prakash Verma, Lee Huntington, Marc Coons, Yukio Kawashima, Takeshi Yamazaki, & Arman Zaribafiyan

The method of increments and frozen natural orbital (MI-FNO) framework is introduced to help expedite the application of noisy, intermediate-scale quantum (NISQ) devices for quantum chemistry simulations. The MI-FNO framework provides a systematic reduction of the occupied and virtual orbital spaces for quantum chemistry simulations. The correlation energies of the resulting increments from the MI-FNO reduction can then be solved by various algorithms, including quantum algorithms such as the phase estimation algorithm and the variational quantum eigensolver (VQE)…

## Variationally Scheduled Quantum Simulation

By Shunji Matsuura, Samantha Buck, Valentin Senicourt, & Arman Zaribafiyan

Eigenstate preparation is ubiquitous in quantum computing, and a standard approach for generating the lowest-energy states of a given system is by employing adiabatic state preparation (ASP). In the present work, we investigate a variational method for determining the optimal scheduling procedure within the context of ASP. In the absence of quantum error correction, running a quantum device for any meaningful amount of time causes a system to become susceptible to the loss of relevant information…

## Efficient and Accurate Electronic Structure Simulation Demonstrated on a Trapped-Ion Quantum Computer

By Yukio Kawashima, Marc P. Coons, Yunseong Nam, Erika Lloyd, Shunji Matsuura, Alejandro J. Garza, Sonika Johri, Lee Huntington, Valentin Senicourt, Andrii O. Maksymov, Jason H. V. Nguyen, Jungsang Kim, Nima Alidoust, Arman Zaribafiyan, & Takeshi Yamazaki

Quantum computers have the potential to perform accurate and efficient electronic structure calculations, enabling the simulation of properties of materials. However, today’s noisy, intermediate-scale quantum (NISQ) devices have a limited number of qubits and gate operations due to the presence of errors. Here, we propose a systematically improvable end-to-end pipeline to alleviate these limitations…

## Scaling Overhead of Locality Reduction in Binary Optimization Problems

By Elisabetta Valiante, Maritza Hernandez, Amin Barzegar, & Helmut G. Katzgraber

Recently, there has been considerable interest in solving optimization problems by mapping these onto a binary representation, sparked mostly by the use of quantum annealing machines. Such binary representation is reminiscent of a discrete physical two-state system, such as the Ising model. As such, physics-inspired techniques—commonly used in fundamental physics studies—are ideally suited to solve optimization problems in a binary format…