Large Scale Coarse-grained Molecular Dynamics Simulations of Asphaltenes in Crude Oils based on the SAFT-γ Mie force field


The modelling of the behaviour of crude oils is particularly challenging due to inherent uncertainty concerning the chemical characterization of the system, and also due to the diverse length and time scales involved. This... [ view full abstract ]


  1. Jason Law (Imperial College London)
  2. Guadalupe J. Serratos (Imperial College London)
  3. Erich A Muller (Imperial College London)

Topic Area

Advances in molecular simulation


AMS-1 » Parallel Session - Advances in Molecular Simulation (14:30 - Wednesday, 6th September, Pentland Suite)

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