Predicting Asphaltene Aggregate Structure from Molecular Dynamics Simulation: Comparison to Neutron Total Scattering Data
Author:
Affiliation:
1. ISIS Neutron and Muon Source, Rutherford Appleton Laboratory, Harwell Campus, Didcot OX11 0QX, United Kingdom
2. Department of Chemical Engineering, The University of Utah, 50 South Central Campus Drive, Salt Lake City, Utah 84112, United States
Funder
Engineering and Physical Sciences Research Council
Division of Chemical, Bioengineering, Environmental, and Transport Systems
Publisher
American Chemical Society (ACS)
Subject
Energy Engineering and Power Technology,Fuel Technology,General Chemical Engineering
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.energyfuels.8b03196
Reference53 articles.
1. Simulation of Asphaltene Aggregation through Molecular Dynamics: Insights and Limitations
2. Influence of Asphaltenes in the Properties of Liquid–Liquid Interface between Water and Linear Saturated Hydrocarbons
3. Asphaltene Subfractions Responsible for Stabilizing Water-in-Crude Oil Emulsions. Part 2: Molecular Representations and Molecular Dynamics Simulations
4. A Molecular Dynamics Study of the Effect of Asphaltenes on Toluene/Water Interfacial Tension: Surfactant or Solute?
5. A multiscale method for simulating fluid interfaces covered with large molecules such as asphaltenes
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