Modeling and Simulations for 2D Materials: A ReaxFF Perspective
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DOI: 10.1088/2053-1583/acd7fd
Abstract: Recent advancements in the field of two-dimensional (2D) materials have led to the discovery of a wide range of 2D materials with intriguing properties. Atomistic-scale simulation methods have played a key role in these discoveries.… read more here.
Keywords: simulations materials; modeling simulations; reaxff perspective; materials reaxff ... See more keywords