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Showing 1 to 1 of 1 for “"Autonomous Basin Climb"”.
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Atomistic Study of Grain Boundary Sliding
… of the MD method, we adopt a novel algorithm, Autonomous Basin Climbing (ABC) in conjunction with Nudged Elastic Band (NEB) and Transition State Theory (TST) to do atomistic calculation. The observations in atomistic calculations, that the sliding rate is lower than the previous atomistic …