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Unitary Coupled Cluster: Seizing the Quantum Moment

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arxiv 2305.01097 v1 pith:FCPV7HTV submitted 2023-05-01 physics.chem-ph quant-ph

classification physics.chem-phquant-ph
keywords quantumaccuratecircuitsacceleratingchemicallychemistryclustercnot-efficient
verification ladder T0 review T1 audit T2 compute T3 formal

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Shallow, CNOT-efficient quantum circuits are crucial for performing accurate computational chemistry simulations on current noisy quantum hardware. Here, we explore the usefulness of non-iterative energy corrections, based on the method of moments of coupled-cluster theory, for accelerating convergence toward full configuration interaction. Our preliminary numerical results relying on iteratively constructed ans\"{a}tze suggest that chemically accurate energies can be obtained with substantially more compact circuits, implying enhanced resilience to gate and decoherence noise.

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