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Publication: Virtual processes for the behaviour of colloidal silica nanoparticles

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Title Virtual processes for the behaviour of colloidal silica nanoparticles
Authors/Editors* S. Jenkins and S.R. Kirk, M. Persson and J. Carlen,
Where published* Swedish Production Symposium, Gothenburg Sweden
How published* Proceedings
Year* 2007
Volume
Number
Pages
Publisher
Keywords Silica colloid, molecular dynamics, potential of mean force.
Link http://datavet.hv.se/personal/SK/research/taconet/papers/index.html
Abstract
Explicit molecular dynamics simulations were applied to a pair of amorphous silica nanoparticles in aqueous solution, of diameter 3.6 nm and four different background electrolyte concentrations, to extract the mean force acting between the pair of silica nanoparticles. Dependences of the interparticle forces with separation and the background electrolyte concentration were demonstrated. The nature of the interaction of the counterions with charged silica surface sites (deprotonated silanols) was investigated. Dependences of the interparticle potential of mean forces with separation and the background electrolyte concentration for the were demonstrated. The hydrophilic/hydrophobic nature of silica was demonstrated.
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