Simulation of the Elastic and Ultimate Tensile Properties of Diamond, Graphene, Carbon Nanotubes, and Amorphous Carbon Using a Revised ReaxFF Parametrization

Title
Simulation of the Elastic and Ultimate Tensile Properties of Diamond, Graphene, Carbon Nanotubes, and Amorphous Carbon Using a Revised ReaxFF Parametrization
Authors
Keywords
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Journal
JOURNAL OF PHYSICAL CHEMISTRY A
Volume 119, Issue 37, Pages 9710-9721
Publisher
American Chemical Society (ACS)
Online
2015-08-28
DOI
10.1021/acs.jpca.5b05889

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