A Hybrid Off-lattice Kinetic Monte Carlo Methodology for Long-timescale Simulations of Thin Films with Molecular Level Resolution

Stavros Ntioudis

Presentation information

Technical Session

Technical sessions » Tribology Simulation

Multi-scale Simulation 1

Tue. Sep 26, 2023 1:30 PM - 2:50 PM Room E (Room 402/403)

Clelia Righi (University of Bologna, Italy)
Tatsunori Tomota (Toyota Central R&D Labs., Inc., Japan)

2:10 PM - 2:30 PM

[26-E-03] A Hybrid Off-lattice Kinetic Monte Carlo Methodology for Long-timescale Simulations of Thin Films with Molecular Level Resolution

*Stavros Ntioudis¹, James P. Ewen¹, Daniele Dini¹, C. Heath Turner² (1. Department of Mechanical Engineering, Imperial College London, UK, 2. Department of Chemical and Biological Engineering, University of Alabama, USA)

Keywords:Multi-Scale Simulation, kinetic Monte Carlo, Molecular Dynamics, Interfacial thin-film growth

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