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Quantum Monte Carlo tunneling from quantum chemistry to quantum annealing

Mazzola G.
•
Smelyanskiy V. N.
•
Troyer M.
2017
  • journal article

Periodico
PHYSICAL REVIEW. B
Abstract
Quantum tunneling is ubiquitous across different fields, from quantum chemical reactions and magnetic materials to quantum simulators and quantum computers. While simulating the real-time quantum dynamics of tunneling is infeasible for high-dimensional systems, quantum tunneling also shows up in quantum Monte Carlo (QMC) simulations, which aim to simulate quantum statistics with resources growing only polynomially with the system size. Here we extend the recent results obtained for quantum spin models [Phys. Rev. Lett. 117, 180402 (2016)PRLTAO0031-900710.1103/PhysRevLett.117.180402], and we study continuous-variable models for proton transfer reactions. We demonstrate that QMC simulations efficiently recover the scaling of ground-state tunneling rates due to the existence of an instanton path, which always connects the reactant state with the product. We discuss the implications of our results in the context of quantum chemical reactions and quantum annealing, where quantum tunneling is expected to be a valuable resource for solving combinatorial optimization problems.
DOI
10.1103/PhysRevB.96.134305
Archivio
https://hdl.handle.net/20.500.11767/151501
info:eu-repo/semantics/altIdentifier/scopus/2-s2.0-85037163183
https://arxiv.org/abs/1703.08189
https://ricerca.unityfvg.it/handle/20.500.11767/151501
Diritti
open access
license:non specificato
license uri:na
Soggetti
  • Settore PHYS-04/A - F...

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