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Stretching Simulation of FCC Crystal

By Markus Buehler1, Justin Riley1, Joo-Hyoung Lee1, Jeffrey C Grossman2

1. Massachusetts Institute of Technology (MIT) 2. Massachusetts Institute of Technology

This tool simulates a continuous expansion of an FCC crystal while measuring the energy, stresses, etc

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Version 1.1 - published on 07 Feb 2011

doi:10254/nanohub-r10046.2 cite this

This tool is closed source.

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FCC Crystal Geometry Tab Lennard Jones Potential Parameters Tab Strain Increments Parameters Stress vs Simulation Step Plot Simulation Movie in Jmol
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Abstract This tool allows the user to study the elastic properties of an FCC lattice modeled using a Lennard-Jones potential.
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Researchers should cite this work as follows:

  • Markus Buehler; Justin Riley; Joo-Hyoung Lee; Jeffrey C Grossman (2011), "Stretching Simulation of FCC Crystal," http://nanohub.org/resources/stretchfcc. (DOI: 10254/nanohub-r10046.2).

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