MonteCarlo Simulations of Carbon-based Structures Based on Extended Brenner Potential
Petukhov A.V., Fasolino A., Research Institute for Materials, Institute of Theoretical Physics, University of Nijmegen, NL
Extended grand-canonical off-lattice Monte Carlo simulations of the (100) and (111) diamond surfaces have shown that the Brenner potential is extremely accurate in describing the structural properties at surfaces, supporting the recent predictions of new [...]