Factoring in hardware overheads and error correction, the authors predict classical chemistry algorithms stay dominant for most calculations through the 2040s, while quantum phase estimation overtakes full configuration interaction and high-order coupled cluster for small-to-medium molecules in the
Rank- reduced coupled-cluster. iii. tensor hypercontraction of the doubles amplitudes,
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Quantum Advantage in Computational Chemistry?
Factoring in hardware overheads and error correction, the authors predict classical chemistry algorithms stay dominant for most calculations through the 2040s, while quantum phase estimation overtakes full configuration interaction and high-order coupled cluster for small-to-medium molecules in the