Chemical Science · 2022 · 62 citations · 85 references
Natural SciencesChemistryComputer ScienceComputational ChemistryDrug DiscoveryQuantum ComputingComputational Quantum ChemistryComputational Quantum MechanicsMolecular ModelingMolecular SimulationQuantum AlgorithmsQuantum SimulationCatalyst OptimizationDensity MatrixHydrogenationQuantum Chemical ModelingQuantum Chemistry SimulationQuantum Circuit Depth ReductionVariational Quantum AlgorithmsVariational Quantum Simulation
Quantum embedding simulation greatly enhanced the capability of near-term quantum computers on realistic chemical systems and reach accuracy comparable to advanced quantum chemistry methods.
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Quantum Computing in the NISQ era and beyond
John Preskill · Quantum · 2018 · 8.2K citations · Full text
Computing, Computer Science, Physics +17
The path of chemical reactions - the IRC approach
Kenichi Fukui · Accounts of Chemical Research · 1981 · 6.6K citations
A variational eigenvalue solver on a photonic quantum processor
Alberto Peruzzo, Jarrod R. McClean, Peter Shadbolt et al. · Nature Communications · 2014 · 4.6K citations · Full text
Natural Sciences, Chemistry, Physics +17