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Static triplet correlations in glass-forming liquids: A molecular dynamics study
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10.1063/1.4773355
/content/aip/journal/jcp/138/12/10.1063/1.4773355
http://aip.metastore.ingenta.com/content/aip/journal/jcp/138/12/10.1063/1.4773355
View: Figures

Figures

Image of FIG. 1.
FIG. 1.

Triplet correlation functions (a) and (b) for the LJ model (full lines) and the WCA model (dashed line) at T = 0.45.

Image of FIG. 2.
FIG. 2.

Triplet correlation functions (a) and (b) for the LJ model (full lines) and the WCA model (dashed line) at T = 0.45.

Image of FIG. 3.
FIG. 3.

Triplet correlation functions (a) and (b) for the LJ model (full lines) and the WCA model (dashed line) at T = 0.45.

Image of FIG. 4.
FIG. 4.

Temperature dependence of the absolute maxima of the triplet correlations and the structure factors: (a) (filled symbols) and (open symbols); (b) (filled symbols) and (open symbols). The amplitudes of the maxima have been normalized by the corresponding values at T = 4. Circles and square indicate results for LJ and WCA models, respectively.

Image of FIG. 5.
FIG. 5.

Triplet correlation functions S (3)(k, k, cos (θ)) (full lines) and the convolution approximation, Eq. (3) , (dotted line) for the LJ model at T = 0.45. (a) 111 correlations; (b) 121 correlations.

Image of FIG. 6.
FIG. 6.

Direct triplet correlation functions (a) and (b) for the LJ model (full lines) and the WCA model (dashed line) at T = 0.45.

Image of FIG. 7.
FIG. 7.

Direct triplet correlation functions (a) and (b) for the LJ model (full lines) and the WCA model (dashed line) at T = 0.45. The range on the z axis has been limited from below for clarity.

Image of FIG. 8.
FIG. 8.

Direct triplet correlation functions and for the LJ model (full lines) and the WCA model (dashed line) at selected angles (as indicated in the labels) at T = 0.45. The range on the z axis has been limited from below for clarity.

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/content/aip/journal/jcp/138/12/10.1063/1.4773355
2013-02-25
2014-04-25
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752b84549af89a08dbdd7fdb8b9568b5 journal.articlezxybnytfddd
Scitation: Static triplet correlations in glass-forming liquids: A molecular dynamics study
http://aip.metastore.ingenta.com/content/aip/journal/jcp/138/12/10.1063/1.4773355
10.1063/1.4773355
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