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One Dimensional Chemistry and the Generalised Local Density Approximation

Ball, Caleb James

Description

In this thesis we explore two distinct topics: a unique model of one dimensional chemistry and the development of the generalised local density approximation. The specific one dimensional system we study is one in which three dimensional particles, both electrons and nuclei, have been strictly confined to move on a line. This means we retain the Coulomb interaction of the three dimensional particles. This is problematic, the singularity of this...[Show more]

CollectionsOpen Access Theses
Date published: 2017
Type: Thesis (PhD)
URI: http://hdl.handle.net/1885/144608

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