Using Visualisation Techniques and Molecular Dynamics to Study Atoms Diffusing in Glass

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Date
2011
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Volume Title
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The Eurographics Association
Abstract
In this poster, virtual reality and visualisation techniques are used to interpret the output of Molecular Dynamics simulations. In particular, mixtures of sodium-disilicate and potassium-silicate are studied. In such systems, the silicon and oxygen atoms form a disordered network. The alkali atoms are relatively mobile and will diffuse through channels in the silica network. This behaviour is rationalised by considering the concept of accessible free volume .
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@inproceedings{
:10.2312/EG2011/posters/047-048
, booktitle = {
Eurographics 2011 - Posters
}, editor = {
R. Laramee and I. S. Lim
}, title = {{
Using Visualisation Techniques and Molecular Dynamics to Study Atoms Diffusing in Glass
}}, author = {
Flikkema, E.
and
Zhou, Z.
and
Greaves, G. N.
}, year = {
2011
}, publisher = {
The Eurographics Association
}, ISSN = {
1017-4656
}, ISBN = {}, DOI = {
/10.2312/EG2011/posters/047-048
} }
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