| Literature DB >> 17705589 |
Qadir K Timerghazin1, Gilles H Peslherbe.
Abstract
Two or more polar molecules can trap an excess electron either in a dipole-bound fashion where it is located outside of the cluster (dipole-bound electron) or inside the cluster (solvated electron). The topology of the electron density in dipole-bound and solvated-electron clusters has been examined for the paradigm (HF)3- cluster. As spatial confinement of the excess electron increases, a non-nuclear maximum (or attractor) of the electron density eventually forms, which suggests that the solvated electron can be described as a topological atom with its own set of physicochemical properties.Entities:
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Year: 2007 PMID: 17705589 DOI: 10.1063/1.2747250
Source DB: PubMed Journal: J Chem Phys ISSN: 0021-9606 Impact factor: 3.488