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Hyper-REBO

By Xufeng Wang1, Susan Sinnott2, jing xu2, SeongJun Heo2, Wen-Dung Hsu2

1. Purdue University 2. University of Florida

Second-generation reactive empirical bond order(REBO)potential energy expression for hydrocarbons

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Version 1.2.2 - published on 31 May 2011

doi:10.4231/D3PV6B67F cite this

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Abstract

Second-generation reactive empirical bond order(REBO)potential energy expression for hydrocarbons

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Researchers should cite this work as follows:

  • Xufeng Wang; Susan Sinnott; jing xu; SeongJun Heo; Wen-Dung Hsu (2011), "Hyper-REBO," http://nanohub.org/resources/hyperrebo. (DOI: 10.4231/D3PV6B67F).

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