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ReaxFF_class_code
ReaxFF code for simulating atomic systems in ME597A
Launch Tool
Archive Version 1.5
Published on 02 Mar 2012 All versions
doi:10.4231/D3N872Z6Q cite this
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Abstract
This code uses the nanohub/rappture interface in order to set up the parameters for a ReaxFF simulation.
Credits
Adri C. T. van Duin, Ph.D. - Main source code.
Michael F. Russo Jr., Ph.D. - Rappture interface/adaptation
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