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N-Representability in the Quantum Kernel Energy Method

Polkosnik, WalterThe Graduate School and University Center of The City University of New York2018

<p>The Kernel Energy Method (KEM) delivers accurate full molecule energies using less computational resources than standard ab-initio quantum chemical approaches. KEM achieves this efficiency by decomposing a system of atoms into disjoint subsets called kernels. The results of full ab-initio …

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