Evidence for atomic mixing via multiple intermediates during the dynamic interconversion of silicate oligomers in solution |
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Authors: | Jelfs Kim E Flikkema Edwin Bromley Stefan T |
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Institution: | Department of Chemistry, University of Liverpool, Crown Street, Liverpool, L69 7ZD, UK. |
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Abstract: | We investigate Si(8)- and Si(16)-based silicate species via global optimisation searches and ab initio calculations and propose a new multi-mechanism interpretation of the experimentally observed atomic mixing of silicate oligomers in solution. |
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