1. Self-assembly and friction of glycerol monooleate and its hydrolysis products in bulk and confined non-aqueous solvents
- Author
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Joshua Louis Bradley-Shaw, Peter J. Dowding, Philip J. Camp, and Kenneth Lewtas
- Subjects
Aqueous solution ,Chemistry ,General Physics and Astronomy ,02 engineering and technology ,021001 nanoscience & nanotechnology ,Micelle ,Hydrolysis ,chemistry.chemical_compound ,020303 mechanical engineering & transports ,Adsorption ,0203 mechanical engineering ,Chemical engineering ,Glycerol ,Molecule ,Mica ,Physical and Theoretical Chemistry ,0210 nano-technology ,Chemical decomposition - Abstract
Atomistic molecular dynamics simulations are used to study the self-assembly and friction of glycerol monooleate mixed with with oleic acid, glycerol, calcium oleate, or water in n-heptane and toluene solvents. The aim is to determine how chemical degradation products of glycerol monooleate could lead to changes in structural and frictional properties. In bulk solution, almost all mixtures studied contain self-assembled reverse micelles. Under confinement between shearedmica surfaces, the reverse micelles disintegrate, but the distribution of molecules between the surfaces and the centre of the fluid layer depends sensitively on the chemical composition, with more polar mixtures showing stronger adsorption. The measured kinetic friction coefficient is correlated with the extent of surface adsorption: while degradation products lead to increases inthe friction coefficient in most cases, all changes are more pronounced when there is less surface adsorption.
- Published
- 2018
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