A random close packing based algorithm for the generation of continuous random networks |
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| Authors: | A. HannemannJ.C. Schö n,M. Jansen |
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| Affiliation: | Max-Planck-Institut für Festkörperforschung, Heisenbergstr. 1, 70569 Stuttgart, Germany |
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| Abstract: | We present a generally applicable method for the modeling of covalent amorphous networks. The algorithm proceeds by generating random close packings of anions, followed by an optimal placement of the cations. As examples, we apply the algorithm to a-SiO2, a-Si3N4, a-SiO3/2N1/3, and a-B2O3. |
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| Keywords: | 61.43Bn 61.43j 61.43Fs 81.05Kf |
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