Quantum Chemistry Calculations using Energy Derivatives on Quantum Computers
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DOI: 10.1016/j.chemphys.2022.111506
Abstract: Quantum chemistry calculations such as the prediction of molecular properties and modeling of chemical reactions are a few of the critical areas where near-term quantum computers can showcase quantum advantage. We present a method to… read more here.
Keywords: chemistry; energy; chemistry calculations; quantum chemistry ... See more keywords