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Chemistry in one dimension

Loos, Pierre-Francois; Ball, Caleb J.; Gill, Peter


We report benchmark results for one-dimensional (1D) atomic and molecular systems interacting via the Coulomb operator |x|-1. Using various wavefunction-type approaches, such as Hartree-Fock theory, second- and third-order Møller-Plesset perturbation the

CollectionsANU Research Publications
Date published: 2015
Type: Journal article
Source: Physical Chemistry Chemical Physics
DOI: 10.1039/C4CP03571B


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