Improved ReaxFF Force Field Parameters for Au–S–C–H Systems

Improved ReaxFF Force Field Parameters for Au–S–C–H Systems

Bae, Gyun-Tack, Aikens, Christine M.
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Volume:
117
Language:
english
Journal:
The Journal of Physical Chemistry A
DOI:
10.1021/jp405992m
Date:
October, 2013
File:
PDF, 3.35 MB
english, 2013
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