Hybrid Quantum-Classical Eigensolver without Variation or Parametric Gates

The use of near-term quantum devices that lack quantum error correction, for addressing quantum chemistry and physics problems, requires hybrid quantum-classical algorithms and techniques. Here, we present a process for obtaining the eigenenergy spectrum of electronic quantum systems. This is achiev...

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Main Authors: Pejman Jouzdani, Stefan Bringuier
Format: Article
Language:English
Published: MDPI AG 2021-01-01
Series:Quantum Reports
Subjects:
Online Access:https://www.mdpi.com/2624-960X/3/1/8
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author Pejman Jouzdani
Stefan Bringuier
author_facet Pejman Jouzdani
Stefan Bringuier
author_sort Pejman Jouzdani
collection DOAJ
description The use of near-term quantum devices that lack quantum error correction, for addressing quantum chemistry and physics problems, requires hybrid quantum-classical algorithms and techniques. Here, we present a process for obtaining the eigenenergy spectrum of electronic quantum systems. This is achieved by projecting the Hamiltonian of a quantum system onto a limited effective Hilbert space specified by a set of computational bases. From this projection, an effective Hamiltonian is obtained. Furthermore, a process for preparing short depth quantum circuits to measure the corresponding diagonal and off-diagonal terms of the effective Hamiltonian is given, whereby quantum entanglement and ancilla qubits are used. The effective Hamiltonian is then diagonalized on a classical computer using numerical algorithms to obtain the eigenvalues. The use case of this approach is demonstrated for ground state and excited states of BeH<sub>2</sub> and LiH molecules, and the density of states, which agrees well with exact solutions. Additionally, hardware demonstration is presented using IBM quantum devices for H<sub>2</sub> molecule.
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spelling doaj.art-fcde3358fe3c4f8fae2c3d33cea8ce4c2023-12-03T11:51:37ZengMDPI AGQuantum Reports2624-960X2021-01-013113715210.3390/quantum3010008Hybrid Quantum-Classical Eigensolver without Variation or Parametric GatesPejman Jouzdani0Stefan Bringuier1General Atomics, San Diego, CA 92121, USAGeneral Atomics, San Diego, CA 92121, USAThe use of near-term quantum devices that lack quantum error correction, for addressing quantum chemistry and physics problems, requires hybrid quantum-classical algorithms and techniques. Here, we present a process for obtaining the eigenenergy spectrum of electronic quantum systems. This is achieved by projecting the Hamiltonian of a quantum system onto a limited effective Hilbert space specified by a set of computational bases. From this projection, an effective Hamiltonian is obtained. Furthermore, a process for preparing short depth quantum circuits to measure the corresponding diagonal and off-diagonal terms of the effective Hamiltonian is given, whereby quantum entanglement and ancilla qubits are used. The effective Hamiltonian is then diagonalized on a classical computer using numerical algorithms to obtain the eigenvalues. The use case of this approach is demonstrated for ground state and excited states of BeH<sub>2</sub> and LiH molecules, and the density of states, which agrees well with exact solutions. Additionally, hardware demonstration is presented using IBM quantum devices for H<sub>2</sub> molecule.https://www.mdpi.com/2624-960X/3/1/8quantum computingquantum algorithmsquantum chemistry
spellingShingle Pejman Jouzdani
Stefan Bringuier
Hybrid Quantum-Classical Eigensolver without Variation or Parametric Gates
Quantum Reports
quantum computing
quantum algorithms
quantum chemistry
title Hybrid Quantum-Classical Eigensolver without Variation or Parametric Gates
title_full Hybrid Quantum-Classical Eigensolver without Variation or Parametric Gates
title_fullStr Hybrid Quantum-Classical Eigensolver without Variation or Parametric Gates
title_full_unstemmed Hybrid Quantum-Classical Eigensolver without Variation or Parametric Gates
title_short Hybrid Quantum-Classical Eigensolver without Variation or Parametric Gates
title_sort hybrid quantum classical eigensolver without variation or parametric gates
topic quantum computing
quantum algorithms
quantum chemistry
url https://www.mdpi.com/2624-960X/3/1/8
work_keys_str_mv AT pejmanjouzdani hybridquantumclassicaleigensolverwithoutvariationorparametricgates
AT stefanbringuier hybridquantumclassicaleigensolverwithoutvariationorparametricgates