NTNU Nanomechanical Lab, Norwegian University of Science and Technology (NTNU), Trondheim 7491, Norway.
Phys Chem Chem Phys. 2020 Nov 21;22(43):24907-24916. doi: 10.1039/d0cp03092a. Epub 2020 Oct 30.
Microemulsions exist widely in nature, daily life and industrial manufacturing processes, including petroleum production, food processing, drug delivery, new material fabrication, sewage treatment, etc. The mechanical properties of microemulsion droplets and a correlation to their molecular structures are of vital importance to those applications. Despite studies on their physicochemical determinants, there are lots of challenges of exploring the mechanical properties of microemulsions by experimental studies. Herein, atomistic modelling was utilized to study the stability, deformation, and rupture of Janus oligomer enabled water-in-oil microemulsion droplets, aiming at revealing their intrinsic relationship with Janus oligomer based surfactants and oil structures. The self-emulsifying process from a water, oil and surfactant mixture to a single microemulsion droplet was modulated by the amphiphilicity and structure of the surfactants. Four microemulsion systems with an interfacial thickness in the range of 7.4-17.3 Å were self-assembled to explore the effect of the surfactant on the droplet morphology. By applying counter forces on the water core and the surfactant shell, the mechanical stability of the microemulsion droplets was probed at different ambient temperatures. A strengthening response and a softening regime before and after a temperature-dependent peak force were identified followed by the final rupture. This work demonstrates a practical strategy to precisely tune the mechanical properties of a single microemulsion droplet, which can be applied in the formation, de-emulsification, and design of microemulsions in oil recovery and production, drug delivery and many other applications.
微乳液广泛存在于自然界、日常生活和工业制造过程中,包括石油生产、食品加工、药物输送、新材料制造、污水处理等。微乳液液滴的力学性质及其与分子结构的相关性对这些应用至关重要。尽管对其物理化学决定因素进行了研究,但通过实验研究探索微乳液的力学性质仍存在许多挑战。在此,利用原子建模研究了Janus 低聚物赋予的水包油型微乳液液滴的稳定性、变形和破裂,旨在揭示其与基于 Janus 低聚物的表面活性剂和油结构的内在关系。自乳化过程是通过表面活性剂的两亲性和结构将水、油和表面活性剂混合物调制为单一的微乳液液滴。通过对水核和表面活性剂壳施加反向力,在不同环境温度下探测了微乳液液滴的力学稳定性。在温度相关的峰值力前后,确定了强化响应和软化阶段,然后是最终破裂。这项工作展示了一种精确调节单个微乳液液滴力学性质的实用策略,可应用于采油、生产、药物输送和许多其他应用中的微乳液的形成、破乳和设计。