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Abstract

Computations with quantum harmonic oscillators, or qumodes, represents a promising and rapidly evolving approach for quantum computing. Unlike qubits, which are two-level quantum systems, bosonic qumodes can have an infinite number of discrete levels, and can also be represented using continuous-variable bases. One of the most promising applications of quantum computing is the simulation of many-fermion problems, such as those encountered in molecular electronic structure calculations. In this work, we demonstrate how an electronic structure Hamiltonian can be transformed into a system of qumodes through qubit-assisted fermion-to-qumode mapping. After mapping the electronic structure Hamiltonian to a qubit Hamiltonian, we show how to represent it as a linear combination of bosonic gates, which can be universally controlled by qubits. We illustrate the potential of this mapping by applying it to the dihydrogen molecule, mapping the four-qubit Hamiltonian to a qubit-qumode system. The preparation of the trial qumode state and the computation of the expectation value are achieved by coupling the mapped qubit-qumode system with an ancilla qubit. This enables the formulation of bosonic variational quantum eigensolver (VQE) algorithms, such as those on hybrid qubit-qumode gates like echoed conditional displacement (ECD-VQE) or selective number-dependent arbitrary phase (SNAP-VQE), to determine the ground state of the dihydrogen molecule. In circuit quantum electrodynamics (cQED) hardware, these methods can be efficiently implemented using a microwave resonator coupled to two superconducting transmon qubits. We anticipate the reported work will pave the way for simulating many-fermion systems by leveraging the potential of hybrid qubit-qumode quantum devices.

Details

1009240
Title
Simulating electronic structure on bosonic quantum computers
Publication title
arXiv.org; Ithaca
Publication year
2024
Publication date
Oct 17, 2024
Section
Quantum Physics
Publisher
Cornell University Library, arXiv.org
Source
arXiv.org
Place of publication
Ithaca
Country of publication
United States
University/institution
Cornell University Library arXiv.org
e-ISSN
2331-8422
Source type
Working Paper
Language of publication
English
Document type
Working Paper
Publication history
 
 
Online publication date
2024-10-21
Milestone dates
2024-04-16 (Submission v1); 2024-04-27 (Submission v2); 2024-10-17 (Submission v3)
Publication history
 
 
   First posting date
21 Oct 2024
ProQuest document ID
3040139869
Document URL
https://www.proquest.com/working-papers/simulating-electronic-structure-on-bosonic/docview/3040139869/se-2?accountid=208611
Full text outside of ProQuest
Copyright
© 2024. This work is published under http://arxiv.org/licenses/nonexclusive-distrib/1.0/ (the “License”). Notwithstanding the ProQuest Terms and Conditions, you may use this content in accordance with the terms of the License.
Last updated
2024-10-22
Database
ProQuest One Academic