Modeling of selenium telluride glass

John Mauro, Arun K. Varshneya

Research output: Contribution to journalArticle

7 Scopus citations


We develop model interaction potentials for the heterogeneous selenium-tollurium system based on ab initio molecular simulations and a cluster expansion technique. The model potentials are used in classical Monte Carlo simulations to characterize the structure of SeTe glass in the canonical ensemble. The simulated structure is in good qualitative agreement with available experimental data.

Original languageEnglish (US)
JournalPhysica Status Solidi (B) Basic Research
Issue number6
StatePublished - May 1 2005


All Science Journal Classification (ASJC) codes

  • Electronic, Optical and Magnetic Materials
  • Condensed Matter Physics

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