PulseExploreJournal ClubDebatesTrendingResearchersJournals
Instagram
HomeExploreJournal ClubTrending
Synapse
⌘+K
Synapse
February 12, 2026Langmuir0 citations

Salinity-Induced Suppression of Interfacial Activity and Anisotropic Water Diffusion in Nanoscale Slits: Insights from Molecular Dynamics Simulations

View Full Paper
LWLi WeiHWHuan WanXZX. T. Zhang

Key Points

  • This research aims to explore how varying salinity levels influence surfactant behavior and water diffusion in nanoscale confinement.
  • Employ all-atom molecular dynamics simulations
  • Analyze a betaine-type zwitterionic surfactant at an oil-water interface
  • Investigate different NaCl concentrations (0.5 to 3.0 M) in 10 nm slits
  • Surfactant thickens the interface and reduces water diffusion in both directions.
  • Higher salinity suppresses the surfactant-induced interfacial broadening.
  • Water diffusion shows marked anisotropy, with lateral diffusion strongly hindered by salinity.

Abstract

Understanding the coupled effects of salinity and nanoconfinement on surfactant behavior is paramount for optimizing enhanced oil recovery (EOR) in deep-sea and tight reservoirs. Herein, we employ all-atom molecular dynamics simulations to investigate the interfacial structure and dynamics of a betaine-type zwitterionic surfactant at an oil-water interface confined within a 10 nm slit, under varying NaCl concentrations (0.5, 1.0, 2.0, and 3.0 M) mimicking real deepwater tight-reservoir conditions, with oil confined in nanoscale rock pores. Our results reveal that the surfactant significantly thickens the interface and reduces water diffusivity in both parallel and perpendicular directions. Increasing the salinity partially suppresses the surfactant-induced interfacial broadening. The interfacial thickness exhibits a nonmonotonic dependence on NaCl concentration, showing a reproducible local minimum at 0.5 M and only modest variations across 1.0-3.0 M, while remaining substantially larger than the surfactant-free reference interface. This suppression is attributed to strong electrostatic interactions between the ions and the surfactant headgroups. Concurrently, the orientational order parameter of the surfactant tails decreases with increasing salinity. Crucially, water diffusion exhibits marked anisotropy: lateral diffusion is strongly hindered by high salinity, with a decreasing diffusion rate for higher salinity. In contrast, vertical diffusion remains largely insensitive to salinity with its magnitude primarily governed by geometric confinement, highlighting the dominant role of geometric confinement over solute effects in the normal direction. These findings provide atomic-level insights into the failure mechanisms of surfactant flooding in high-salinity reservoirs and design principles for next-generation EOR agents that can withstand the dual challenges of ion screening and nanoconfinement.

Ask AI
Helpful
Bookmark
Share
View Full Paper

Cite This Study

Wei et al. (2026) studied this question.

synapsesocial.com/papers/698d6d445be6419ac0d523bdhttps://doi.org/10.1021/acs.langmuir.5c05687
Ask AI
Helpful
Bookmark
Share
View Full Paper