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- W2005133885 abstract "Abstract We develop model interaction potentials for the binary As–Se system using ab initio molecular simulations and a cluster expansion technique. These potentials are used with classical Monte Carlo simulations to characterize the structure of As 2 Se 3 , AsSe 2 , and AsSe glasses. Finally, we compute the fraction of soft modes in the As–Se system as a function of average coordination number. The results show evidence of a rigidity percolation threshold at an average coordination number between 2.3 and 2.4." @default.
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- W2005133885 date "2007-05-01" @default.
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- W2005133885 title "Multiscale modeling of arsenic selenide glass" @default.
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- W2005133885 doi "https://doi.org/10.1016/j.jnoncrysol.2006.09.067" @default.
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