Molecular Dynamics Study of the Aggregation Behavior of Polycyclic Aromatic Hydrocarbon Molecules in n-Heptane–Toluene Mixtures: Assessing the Heteroatom Content Effect

This study is focused on evaluating the aggregation behavior of four asphaltene molecules (PA3-type) dissolved in three different solvents. Hence, solution models composed of asphaltenes dissolved ...