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PubMed Publications| Keyword search (4,163 papers available) |  |
"Qadir K Timerghazin" Authored Publications:
| Title | Authors | PubMed ID | |
|---|---|---|---|
| 1 | Further insight into the relaxation dynamics of photoexcited I-(H2O)n clusters | Qadir K Timerghazin | 12914436 CERMM |
| 2 | Accurate ab initio potential for the Na+...I* complex | Qadir K Timerghazin | 16438589 CERMM |
| 3 | Resonance description of S-nitrosothiols: insights into reactivity | Qadir K Timerghazin | 17616141 CERMM |
| 4 | Non-nuclear attractor of electron density as a manifestation of the solvated electron | Qadir K Timerghazin | 17705589 CERMM |
| 5 | Electronic structure of the acetonitrile and acetonitrile dimer anions: a topological investigation | Qadir K Timerghazin | 18154288 CERMM |
| 6 | Structure and stability of HSNO, the simplest S-nitrosothiol | Qadir K Timerghazin | 18327309 CHEMBIOCHEM |
| Title: | Non-nuclear attractor of electron density as a manifestation of the solvated electron | ||||
| Authors: | Qadir K Timerghazin | ||||
| Link: | https://pubmed.ncbi.nlm.nih.gov/17705589/ | ||||
| DOI: | 10.1063/1.2747250 | ||||
| Publication: | The Journal of chemical physics | ||||
| Keywords: | |||||
| PMID: | 17705589 | Category: | Date Added: | 2007-08-21 | |
| Dept Affiliation: |
CERMM
1 Centre for Research in Molecular Modeling, Concordia University, Montréal, Québec H4B 1R6, Canada. |
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Description: |
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... |
