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  1. Article ; Online: Towards near-term quantum simulation of materials.

    Clinton, Laura / Cubitt, Toby / Flynn, Brian / Gambetta, Filippo Maria / Klassen, Joel / Montanaro, Ashley / Piddock, Stephen / Santos, Raul A / Sheridan, Evan

    Nature communications

    2024  Volume 15, Issue 1, Page(s) 211

    Abstract: Determining the ground and excited state properties of materials is considered one of the most promising applications of quantum computers. On near-term hardware, the limiting constraint on such simulations is the requisite circuit depths and qubit ... ...

    Abstract Determining the ground and excited state properties of materials is considered one of the most promising applications of quantum computers. On near-term hardware, the limiting constraint on such simulations is the requisite circuit depths and qubit numbers, which currently lie well beyond near-term capabilities. Here we develop a quantum algorithm which reduces the estimated cost of material simulations. For example, we obtain a circuit depth improvement by up to 6 orders of magnitude for a Trotter layer of time-dynamics simulation in the transition-metal oxide SrVO
    Language English
    Publishing date 2024-01-24
    Publishing country England
    Document type Journal Article
    ZDB-ID 2553671-0
    ISSN 2041-1723 ; 2041-1723
    ISSN (online) 2041-1723
    ISSN 2041-1723
    DOI 10.1038/s41467-023-43479-6
    Database MEDical Literature Analysis and Retrieval System OnLINE

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  2. Article ; Online: Observing ground-state properties of the Fermi-Hubbard model using a scalable algorithm on a quantum computer.

    Stanisic, Stasja / Bosse, Jan Lukas / Gambetta, Filippo Maria / Santos, Raul A / Mruczkiewicz, Wojciech / O'Brien, Thomas E / Ostby, Eric / Montanaro, Ashley

    Nature communications

    2022  Volume 13, Issue 1, Page(s) 5743

    Abstract: The famous, yet unsolved, Fermi-Hubbard model for strongly-correlated electronic systems is a prominent target for quantum computers. However, accurately representing the Fermi-Hubbard ground state for large instances may be beyond the reach of near-term ...

    Abstract The famous, yet unsolved, Fermi-Hubbard model for strongly-correlated electronic systems is a prominent target for quantum computers. However, accurately representing the Fermi-Hubbard ground state for large instances may be beyond the reach of near-term quantum hardware. Here we show experimentally that an efficient, low-depth variational quantum algorithm with few parameters can reproduce important qualitative features of medium-size instances of the Fermi-Hubbard model. We address 1 × 8 and 2 × 4 instances on 16 qubits on a superconducting quantum processor, substantially larger than previous work based on less scalable compression techniques, and going beyond the family of 1D Fermi-Hubbard instances, which are solvable classically. Consistent with predictions for the ground state, we observe the onset of the metal-insulator transition and Friedel oscillations in 1D, and antiferromagnetic order in both 1D and 2D. We use a variety of error-mitigation techniques, including symmetries of the Fermi-Hubbard model and a recently developed technique tailored to simulating fermionic systems. We also introduce a new variational optimisation algorithm based on iterative Bayesian updates of a local surrogate model.
    Language English
    Publishing date 2022-10-11
    Publishing country England
    Document type Journal Article
    ZDB-ID 2553671-0
    ISSN 2041-1723 ; 2041-1723
    ISSN (online) 2041-1723
    ISSN 2041-1723
    DOI 10.1038/s41467-022-33335-4
    Database MEDical Literature Analysis and Retrieval System OnLINE

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  3. Book ; Online: Towards near-term quantum simulation of materials

    Clinton, Laura / Cubitt, Toby / Flynn, Brian / Gambetta, Filippo Maria / Klassen, Joel / Montanaro, Ashley / Piddock, Stephen / Santos, Raul A. / Sheridan, Evan

    2022  

    Abstract: Simulation of materials is one of the most promising applications of quantum computers. On near-term hardware the crucial constraint on these simulations is circuit depth. Many quantum simulation algorithms rely on a layer of unitary evolutions generated ...

    Abstract Simulation of materials is one of the most promising applications of quantum computers. On near-term hardware the crucial constraint on these simulations is circuit depth. Many quantum simulation algorithms rely on a layer of unitary evolutions generated by each term in a Hamiltonian. This appears in time-dynamics as a single Trotter step, and in variational quantum eigensolvers under the Hamiltonian variational ansatz as a single ansatz layer. We present a new quantum algorithm design for materials modelling where the depth of a layer is independent of the system size. This design takes advantage of the locality of materials in the Wannier basis and employs a tailored fermionic encoding that preserves locality. We analyse the circuit costs of this approach and present a compiler that transforms density functional theory data into quantum circuit instructions -- connecting the physics of the material to the simulation circuit. The compiler automatically optimises circuits at multiple levels, from the base gate level to optimisations derived from the physics of the specific target material. We present numerical results for materials spanning a wide structural and technological range. Our results demonstrate a reduction of many orders of magnitude in circuit depth over standard prior methods that do not consider the structure of the Hamiltonian. For example our results improve resource requirements for Strontium Vanadate (SrVO$_3$) from 864 to 180 qubits for a $3\times3\times3$ lattice, and the circuit depth of a single Trotter or variational layer from $7.5\times 10^8$ to depth $730$. Although this is still beyond current hardware, our results show that materials simulation may be feasible on quantum computers without necessarily requiring scalable, fault-tolerant quantum computers, provided quantum algorithm design incorporates understanding of the materials and applications.

    Comment: 94 pages, 38 figures, 11 tables
    Keywords Quantum Physics ; Condensed Matter - Materials Science ; Condensed Matter - Strongly Correlated Electrons
    Subject code 620
    Publishing date 2022-05-30
    Publishing country us
    Document type Book ; Online
    Database BASE - Bielefeld Academic Search Engine (life sciences selection)

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  4. Book ; Online: Engineering non-binary Rydberg interactions via phonons in an optical lattice

    Gambetta, Filippo Maria / Li, Weibin / Schmidt-Kaler, Ferdinand / Lesanovsky, Igor

    2019  

    Abstract: Coupling electronic and vibrational degrees of freedom of Rydberg atoms held in optical tweezer arrays offers a flexible mechanism for creating and controlling atom-atom interactions. We find that the state-dependent coupling between Rydberg atoms and ... ...

    Abstract Coupling electronic and vibrational degrees of freedom of Rydberg atoms held in optical tweezer arrays offers a flexible mechanism for creating and controlling atom-atom interactions. We find that the state-dependent coupling between Rydberg atoms and local oscillator modes gives rise to two- and three-body interactions which are controllable through the strength of the local confinement. This approach even permits the cancellation of two-body terms such that three-body interactions become dominant. We analyze the structure of these interactions on two-dimensional bipartite lattice geometries and explore the impact of three-body interactions on system ground state on a square lattice. Focusing specifically on a system of $ ^{87} $Rb atoms, we show that the effects of the multi-body interactions can be maximized via a tailored dressed potential within a trapping frequency range of the order of a few hundred kHz and for temperatures corresponding to a $ >90\% $ occupation of the atomic vibrational ground state. These parameters, as well as the multi-body induced time scales, are compatible with state-of-the-art arrays of optical tweezers. Our work shows a highly versatile handle for engineering multi-body interactions of quantum many-body systems in most recent manifestations on Rydberg lattice quantum simulators.

    Comment: Main text: 6 pages, 4 figures; Supplemental Material: 6 pages, 6 figures
    Keywords Condensed Matter - Quantum Gases ; Physics - Atomic Physics
    Subject code 612 ; 530
    Publishing date 2019-07-26
    Publishing country us
    Document type Book ; Online
    Database BASE - Bielefeld Academic Search Engine (life sciences selection)

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