Literature DB >> 29601758

Quantum Simulation of Electronic Structure with Linear Depth and Connectivity.

Ian D Kivlichan1,2, Jarrod McClean1, Nathan Wiebe3, Craig Gidney4, Alán Aspuru-Guzik2, Garnet Kin-Lic Chan5, Ryan Babbush1.   

Abstract

As physical implementations of quantum architectures emerge, it is increasingly important to consider the cost of algorithms for practical connectivities between qubits. We show that by using an arrangement of gates that we term the fermionic swap network, we can simulate a Trotter step of the electronic structure Hamiltonian in exactly N depth and with N^{2}/2 two-qubit entangling gates, and prepare arbitrary Slater determinants in at most N/2 depth, all assuming only a minimal, linearly connected architecture. We conjecture that no explicit Trotter step of the electronic structure Hamiltonian is possible with fewer entangling gates, even with arbitrary connectivities. These results represent significant practical improvements on the cost of most Trotter-based algorithms for both variational and phase-estimation-based simulation of quantum chemistry.

Year:  2018        PMID: 29601758     DOI: 10.1103/PhysRevLett.120.110501

Source DB:  PubMed          Journal:  Phys Rev Lett        ISSN: 0031-9007            Impact factor:   9.161


  11 in total

1.  Chemistry beyond the Hartree-Fock energy via quantum computed moments.

Authors:  Michael A Jones; Harish J Vallury; Charles D Hill; Lloyd C L Hollenberg
Journal:  Sci Rep       Date:  2022-05-28       Impact factor: 4.996

2.  Barren plateaus in quantum neural network training landscapes.

Authors:  Jarrod R McClean; Sergio Boixo; Vadim N Smelyanskiy; Ryan Babbush; Hartmut Neven
Journal:  Nat Commun       Date:  2018-11-16       Impact factor: 14.919

3.  Realization of efficient quantum gates with a superconducting qubit-qutrit circuit.

Authors:  T Bækkegaard; L B Kristensen; N J S Loft; C K Andersen; D Petrosyan; N T Zinner
Journal:  Sci Rep       Date:  2019-09-16       Impact factor: 4.379

4.  Quantum Chemistry on Quantum Computers: A Method for Preparation of Multiconfigurational Wave Functions on Quantum Computers without Performing Post-Hartree-Fock Calculations.

Authors:  Kenji Sugisaki; Shigeaki Nakazawa; Kazuo Toyota; Kazunobu Sato; Daisuke Shiomi; Takeji Takui
Journal:  ACS Cent Sci       Date:  2018-12-31       Impact factor: 14.553

5.  Decoding quantum errors with subspace expansions.

Authors:  Jarrod R McClean; Zhang Jiang; Nicholas C Rubin; Ryan Babbush; Hartmut Neven
Journal:  Nat Commun       Date:  2020-01-31       Impact factor: 14.919

6.  Towards the simulation of large scale protein-ligand interactions on NISQ-era quantum computers.

Authors:  Fionn D Malone; Robert M Parrish; Alicia R Welden; Thomas Fox; Matthias Degroote; Elica Kyoseva; Nikolaj Moll; Raffaele Santagati; Michael Streif
Journal:  Chem Sci       Date:  2022-01-17       Impact factor: 9.825

7.  A systematic variational approach to band theory in a quantum computer.

Authors:  Kyle Sherbert; Frank Cerasoli; Marco Buongiorno Nardelli
Journal:  RSC Adv       Date:  2021-12-10       Impact factor: 3.361

8.  Scaling quantum approximate optimization on near-term hardware.

Authors:  Phillip C Lotshaw; Thien Nguyen; Anthony Santana; Alexander McCaskey; Rebekah Herrman; James Ostrowski; George Siopsis; Travis S Humble
Journal:  Sci Rep       Date:  2022-07-20       Impact factor: 4.996

9.  A quantum algorithm for spin chemistry: a Bayesian exchange coupling parameter calculator with broken-symmetry wave functions.

Authors:  Kenji Sugisaki; Kazuo Toyota; Kazunobu Sato; Daisuke Shiomi; Takeji Takui
Journal:  Chem Sci       Date:  2020-12-24       Impact factor: 9.825

10.  Quantum machine learning for electronic structure calculations.

Authors:  Rongxin Xia; Sabre Kais
Journal:  Nat Commun       Date:  2018-10-10       Impact factor: 14.919

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