4.6 Article

On the use of the Laplace transform in local correlation methods

Journal

PHYSICAL CHEMISTRY CHEMICAL PHYSICS
Volume 10, Issue 23, Pages 3430-3439

Publisher

ROYAL SOC CHEMISTRY
DOI: 10.1039/b802993h

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The applicability of the Laplace transform ansatz of Almlof in the context of local correlation methods with a priori restricted sets of wavefunction parameters is explored. A new local MP2 method based on the Laplace transform ansatz is described, its relation to the local MP2 method based on the Pulay ansatz is elucidated, and its accuracy and efficiency are compared to the latter.

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