Coarse-grained intermolecular interactions on quantum processors

Variational quantum algorithms (VQAs) are increasingly being applied in simulations of strongly bound (covalently bonded) systems using full molecular orbital basis representations. The application of quantum computers to the weakly bound intermolecular and noncovalently bonded regime, however, has...

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Main Authors: Anderson, LW, Kiffner, M, Barkoutsos, PK, Tavernelli, I, Crain, J, Jaksch, D
格式: Journal article
语言:English
出版: American Physical Society 2022