Graphene Force Field Parameters For Computational Simulations

Force field parameters for graphene are crucial for accurately simulating its behavior using computational methods. These parameters determine the interatomic interactions within the graphene lattice and influence its properties. Force field parameters for graphene are available from various sources, such as those developed by Tersoff and Brenner. Selecting appropriate force field parameters is essential for obtaining reliable simulation results and understanding the mechanical, thermal, and electronic properties of graphene-based materials.

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