817 citations · 4.9k across the 42 of their papers we have counts for
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quant-ph2009★ 76 cited
Quantum Algorithm for Molecular Properties and Geometry Optimization
Ivan Kassal, Alán Aspuru-Guzik
It is known that quantum computers, if available, would allow an exponential decrease in the computational cost of quantum simulations. We extend this result to show that the compu…
quant-ph2009★ 804 cited
Towards Quantum Chemistry on a Quantum Computer
Benjamin P. Lanyon, James D. Whitfield, Geoff G. Gillet +9
The fundamental problem faced in quantum chemistry is the calculation of molecular properties, which are of practical importance in fields ranging from materials science to biochem…