Department of Mechanical Engineering, Imperial College London, South Kensington Campus, SW7 2AZ London, UK.
Institute of Molecular Science and Engineering, Imperial College London, South Kensington Campus, SW7 2AZ London, UK.
Nanoscale. 2023 Apr 13;15(15):7086-7104. doi: 10.1039/d2nr05545g.
We investigate the nanoscale friction between biomimetic hair surfaces using chemical colloidal probe atomic force microscopy experiments and nonequilibrium molecular dynamics simulations. In the experiments, friction is measured between water-lubricated silica surfaces functionalised with monolayers formed from either octadecyl or sulfonate groups, which are representative of the surfaces of virgin and ultimately bleached hair, respectively. In the simulations, friction is monitored between coarse-grained model hair surfaces with different levels of chemical damage, where a specified amount of grafted octadecyl groups are randomly replaced with sulfonate groups. The sliding velocity dependence of friction in the simulations can be described using an extended stress-augmented thermally activation model. As the damage level increases in the simulations, the friction coefficient generally increases, but its sliding velocity-dependence decreases. At low sliding velocities, which are closer to those encountered experimentally and physiologically, we observe a monotonic increase of the friction coefficient with damage ratio, which is consistent with our new experiments using biomimetic surfaces and previous ones using real hair. This observation demonstrates that modified surface chemistry, rather than roughness changes or subsurface damage, control the increase in nanoscale friction of bleached or chemically damaged hair. We expect the methods and biomimetic surfaces proposed here to be useful to screen the tribological performance of hair care formulations both experimentally and computationally.
我们使用化学胶体探针原子力显微镜实验和非平衡分子动力学模拟研究了仿生毛发表面的纳米级摩擦。在实验中,测量了水润滑的二氧化硅表面与分别由十八烷基或磺酸盐基团形成的单层之间的摩擦,这分别代表了原始和最终漂白毛发的表面。在模拟中,监测了具有不同化学损伤水平的粗粒模型毛发表面之间的摩擦,其中指定数量的接枝十八烷基基团被随机替换为磺酸盐基团。模拟中摩擦的滑动速度依赖性可以用扩展的应力增强热激活模型来描述。随着模拟中损伤水平的增加,摩擦系数通常会增加,但滑动速度依赖性会降低。在更接近实验和生理条件的低滑动速度下,我们观察到摩擦系数随着损伤比的单调增加而增加,这与我们使用仿生表面进行的新实验以及以前使用真实毛发进行的实验一致。这一观察结果表明,修饰的表面化学性质而非粗糙度变化或亚表面损伤控制了漂白或化学损伤毛发纳米级摩擦的增加。我们期望这里提出的方法和仿生表面能够在实验和计算上都有助于筛选头发护理制剂的摩擦性能。