Quantum chemistry in the age of quantum computing

Y Cao, J Romero, JP Olson, M Degroote… - Chemical …, 2019 - ACS Publications
Practical challenges in simulating quantum systems on classical computers have been
widely recognized in the quantum physics and quantum chemistry communities over the …

Quantum computational chemistry

S McArdle, S Endo, A Aspuru-Guzik, SC Benjamin… - Reviews of Modern …, 2020 - APS
One of the most promising suggested applications of quantum computing is solving
classically intractable chemistry problems. This may help to answer unresolved questions …

Hybrid quantum-classical hierarchy for mitigation of decoherence and determination of excited states

JR McClean, ME Kimchi-Schwartz, J Carter… - Physical Review A, 2017 - APS
Using quantum devices supported by classical computational resources is a promising
approach to quantum-enabled computation. One powerful example of such a hybrid …

Strategies for solving the Fermi-Hubbard model on near-term quantum computers

C Cade, L Mineh, A Montanaro, S Stanisic - Physical Review B, 2020 - APS
The Fermi-Hubbard model is of fundamental importance in condensed-matter physics, yet is
extremely challenging to solve numerically. Finding the ground state of the Hubbard model …

Hybrid quantum-classical approach to correlated materials

B Bauer, D Wecker, AJ Millis, MB Hastings, M Troyer - Physical Review X, 2016 - APS
Recent improvements in the control of quantum systems make it seem feasible to finally
build a quantum computer within a decade. While it has been shown that such a quantum …

Simulating quantum materials with digital quantum computers

LB Oftelie, M Urbanek, M Metcalf, J Carter… - Quantum Science …, 2021 - iopscience.iop.org
Quantum materials exhibit a wide array of exotic phenomena and practically useful
properties. A better understanding of these materials can provide deeper insights into …

Low-depth circuit ansatz for preparing correlated fermionic states on a quantum computer

PL Dallaire-Demers, J Romero, L Veis… - Quantum Science …, 2019 - iopscience.iop.org
Quantum simulations are bound to be one of the main applications of near-term quantum
computers. Quantum chemistry and condensed matter physics are expected to benefit from …

Digital Quantum Simulation of Minimal

L García-Álvarez, IL Egusquiza, L Lamata… - Physical review …, 2017 - APS
We propose the digital quantum simulation of a minimal AdS/CFT model in controllable
quantum platforms. We consider the Sachdev-Ye-Kitaev model describing interacting …

Symmetry-adapted variational quantum eigensolver

K Seki, T Shirakawa, S Yunoki - Physical Review A, 2020 - APS
We propose a scheme to restore spatial symmetry of Hamiltonian in the variational-quantum-
eigensolver (VQE) algorithm for which the quantum circuit structures used usually break the …

Calculating energy derivatives for quantum chemistry on a quantum computer

TE O'Brien, B Senjean, R Sagastizabal… - npj Quantum …, 2019 - nature.com
Modeling chemical reactions and complicated molecular systems has been proposed as the
“killer application” of a future quantum computer. Accurate calculations of derivatives of …