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Multi-Scale Simulation

Related Publications

• Cooperation between adsorbates accounts for the activation of atomic layer deposition reactions
  Nanoscale volume 7 issue 14 pages 6311 to 6318 (2015)
  Authors: Mahdi Shirazi, Simon D. Elliott

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• Atomistic kinetic Monte Carlo study of atomic layer deposition derived from density functional theory
  Journal of Computational Chemistry volume 35 issue 3 pages 244 to 259 (2013)
  Authors: Mahdi Shirazi, Simon D. Elliott

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• Multiple Proton Diffusion and Film Densification in Atomic Layer Deposition Modeled by Density Functional Theory
  Chemistry of Materials volume 25 issue 6 pages 878 to 889 (2013)
  Authors: Mahdi Shirazi, Simon D. Elliott

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