Toh William, Ang Elisa Yun Mei, Lin Rongming, Liu Zishun, Ng Teng Yong
School of Mechanical and Aerospace Engineering, Nanyang Technological University, 50 Nanyang Avenue, 639798 Singapore.
Engineering Cluster, Singapore Institute of Technology, 10 Dover Drive, 138683, Singapore.
ACS Appl Mater Interfaces. 2022 Jun 6. doi: 10.1021/acsami.2c05425.
In this paper, we perform molecular dynamics simulations to investigate the performance of multilayer graphene slit membranes. Graphene slit membranes at a critical slit size have been found to be promising desalination membranes. In this contribution, it is shown that multilayer slit membranes have the potential to provide significantly better permeability while retaining outstanding salt rejection. Improved permeability of the membrane is achieved by using slits of widths larger than the critical slit size required to reject salt through size exclusion, and desalination of sea water is performed by increased resistance to salt passage through the multilayering. To facilitate the design process of future multilayer membranes, we analyze the flow resistance of the membrane as a combination of electrical resistors in series and show that this analogy works for membranes where the layers possess the same slit size, as well as membranes with layers of different slit sizes. Comparing with single layer graphene membranes, it was shown that it is possible to obtain 55% improvement in permeability without loss in salt rejection capabilities through multilayering. This opens up possibilities for membrane designers to be free from the restrictions of using a single layer graphene slit membrane with a fixed slit width.
在本文中,我们进行分子动力学模拟以研究多层石墨烯狭缝膜的性能。已发现临界狭缝尺寸的石墨烯狭缝膜有望成为脱盐膜。在本研究中,结果表明多层狭缝膜在保持出色的盐分截留率的同时,有潜力提供显著更高的渗透率。通过使用宽度大于通过尺寸排阻截留盐分所需的临界狭缝尺寸的狭缝来实现膜渗透率的提高,并且通过增加盐分穿过多层结构的阻力来进行海水脱盐。为便于未来多层膜的设计过程,我们将膜的流动阻力分析为串联电阻器的组合,并表明这种类比适用于各层具有相同狭缝尺寸的膜以及具有不同狭缝尺寸层的膜。与单层石墨烯膜相比,结果表明通过多层结构可以在不损失盐分截留能力的情况下使渗透率提高55%。这为膜设计者开辟了可能性,使其不受使用具有固定狭缝宽度的单层石墨烯狭缝膜的限制。