Literature DB >> 26273989

Exploiting Locality in Quantum Computation for Quantum Chemistry.

Jarrod R McClean1, Ryan Babbush1, Peter J Love2, Alán Aspuru-Guzik1.   

Abstract

Accurate prediction of chemical and material properties from first-principles quantum chemistry is a challenging task on traditional computers. Recent developments in quantum computation offer a route toward highly accurate solutions with polynomial cost; however, this solution still carries a large overhead. In this Perspective, we aim to bring together known results about the locality of physical interactions from quantum chemistry with ideas from quantum computation. We show that the utilization of spatial locality combined with the Bravyi-Kitaev transformation offers an improvement in the scaling of known quantum algorithms for quantum chemistry and provides numerical examples to help illustrate this point. We combine these developments to improve the outlook for the future of quantum chemistry on quantum computers.

Year:  2014        PMID: 26273989     DOI: 10.1021/jz501649m

Source DB:  PubMed          Journal:  J Phys Chem Lett        ISSN: 1948-7185            Impact factor:   6.475


  7 in total

1.  Quantum reform.

Authors:  Leonie Mueck
Journal:  Nat Chem       Date:  2015-05       Impact factor: 24.427

2.  Programming languages and compiler design for realistic quantum hardware.

Authors:  Frederic T Chong; Diana Franklin; Margaret Martonosi
Journal:  Nature       Date:  2017-09-13       Impact factor: 49.962

3.  Elucidating reaction mechanisms on quantum computers.

Authors:  Markus Reiher; Nathan Wiebe; Krysta M Svore; Dave Wecker; Matthias Troyer
Journal:  Proc Natl Acad Sci U S A       Date:  2017-07-03       Impact factor: 11.205

4.  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

5.  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

6.  Adiabatic quantum simulation of quantum chemistry.

Authors:  Ryan Babbush; Peter J Love; Alán Aspuru-Guzik
Journal:  Sci Rep       Date:  2014-10-13       Impact factor: 4.379

7.  A Comparison of the Bravyi-Kitaev and Jordan-Wigner Transformations for the Quantum Simulation of Quantum Chemistry.

Authors:  Andrew Tranter; Peter J Love; Florian Mintert; Peter V Coveney
Journal:  J Chem Theory Comput       Date:  2018-10-02       Impact factor: 6.006

  7 in total

北京卡尤迪生物科技股份有限公司 © 2022-2023.