Computer Simulation Studies of Adsorption of Binary and Ternary Mixtures of Gasoline Components in Engine Deposits

Carbonaceous deposits can accumulate on various surfaces of the internal combustion engine and affect its performance. The porous nature of these deposits means that they act like a “sponge”, adsorbing fuel components and changing both the composition and the amount of fuel in the combustion chamber. Here we use a previously developed and validated model of engine deposits to predict adsorption of normal heptane, isooctane, toluene and their mixtures in deposits of different origin within a port fuel injected spark ignition engine (Combustion Chamber Deposits, or CCDs, and Intake Valve Deposits, or IVDs) and under different conditions. We explore the influence of molecular structure of adsorbing species, composition of the bulk mixture and temperature on the uptake and selectivity behaviour of the deposits. While deposits generally show high capacity toward all three components, we observe that selectivity behaviour is a more subtle and complex property.