Exploiting Locality in Quantum Computation for Quantum Chemistry.

J Phys Chem Lett

†Department of Chemistry and Chemical Biology, Harvard University, Cambridge, Massachusetts 02138, United States.

Published: December 2014

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.

Download full-text PDF

Source
http://dx.doi.org/10.1021/jz501649mDOI Listing

Publication Analysis

Top Keywords

quantum chemistry
20
quantum computation
12
quantum
10
chemistry
5
exploiting locality
4
locality quantum
4
computation quantum
4
chemistry accurate
4
accurate prediction
4
prediction chemical
4

Similar Publications

Want AI Summaries of new PubMed Abstracts delivered to your In-box?

Enter search terms and have AI summaries delivered each week - change queries or unsubscribe any time!