An Off-Lattice Kinetic Monte Carlo Framework For Long-Time Atomistic Simulations
The goal of this thesis is to develop an off-lattice Kinetic Monte Carlo (KMC) framework to simulate the atomistic dynamics of materials at extreme conditions over long time scales. Despite the dramatic increase in computational power over the last few decades, rigorous approaches such as classical...
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| Format: | Thesis |
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Massachusetts Institute of Technology
2023
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| Online Access: | https://hdl.handle.net/1721.1/151680 |