Capillary bridges between unsaturated nano-mineral particles: a molecular dynamics study

Literature Information

Publication Date 2022-03-24
DOI 10.1039/D1CP05041A
Impact Factor 3.676
Authors

Yubing Ouyang, Shujian Chen, Kwesi Sagoe-Crentsil, Wenhui Duan


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Abstract

Capillary bridges play an important role in the process of cohesion, which is crucial for wet granular media, and engineering of pharmaceuticals and food processing. However, the understanding of capillary bridges at the nanoscale remains unclear because the mechanical performance of nanoscale capillary bridges cannot be fully captured and explained by classical capillary theory. We applied a novel molecular dynamic simulation to investigate the dynamic formation process of nanoscale capillary bridges between quartz asperities. In comparison with classical capillary theory, our results suggested that the application of the toroidal approximation and gorge method will break down at the scale of 1 nm. Below this threshold, a pronounced oscillation in the adhesive force was observed due to inconsistent distribution of water molecules in the capillary bridges. Moreover, we found a non-linear correlation between the adhesive force and the saturation degree. Different from the cohesive stress of sandy soil as a function of saturation degree, we identified an optimal saturation range of 0.5–0.7 instead of 0.2–0.9 for the sandy soil. Our findings enhance the understanding of capillary bridges and provide new insights into the capillary force between particles in the fields of geotechnical engineering, food-process engineering, the pharmaceutical industry and nanotechnology.

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Source Journal

Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics
CiteScore: 5.5
Self-citation Rate: 10.3%
Articles per Year: 3036

Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.

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