Fault-Tolerant Quantum Algorithm for Symmetry-Adapted Perturbation Theory

Fault-Tolerant Quantum Algorithm for Symmetry-Adapted Perturbation Theory

The efficient computation of observables beyond the total energy is a key challenge and opportunity for fault-tolerant quantum computing approaches in quantum chemistry. Here, we consider the symmetry-adapted perturbation-theory (SAPT) components of the interaction energy as a prototypical example o...

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Bibliographic Details
Main Authors: Cristian L. Cortes, Matthias Loipersberger, Robert M. Parrish, Sam Morley-Short, William Pol, Sukin Sim, Mark Steudtner, Christofer S. Tautermann, Matthias Degroote, Nikolaj Moll, Raffaele Santagati, Michael Streif
Format: Article
Language:English
Published: American Physical Society 2024-03-01
Series:PRX Quantum
Online Access:http://doi.org/10.1103/PRXQuantum.5.010336

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