Abstract
Understanding adhesion behavior between paper materials and inorganic substrate is important to minimize surface contamination by paper fragments. In this work, we investigate adhesion mechanisms between paper sheet and glass in terms of molecular interaction. Molecular dynamics simulations are employed to calculate adhesion force between paper sheet and the silica glass surfaces. Pulling and sliding tests are simulated to find the effects of the paper compositions such as mannan, glucan, and glucuronoxylan and humidity on the adhesion. Simulation results reveal that crystalline cellulose film of mannan unit (uni-directional hydroxyl groups) shows higher adhesion than that of glucan unit (bi-directional hydroxyl groups). Also, addition of just a few glucuronoxylan (xylan) hemicellulose molecules on the cellulose film remarkably enhances adhesion force, because of carboxylic acid groups with strong polarity in xylan. In addition, introduction of humidity leads to a further increase of adhesion due to hydrogen bonds bridged by water molecules. The adhesion force is maximized around 10 H2O/nm2 because as the humidity increases, hydrogen bond interactions are saturated, whereas the Van der Waals interactions decrease due to thicker water layer. It is discussed that consideration of the capillary force for paper may result in different adhesion response that reflects more realistic situation.
Roles of paper composition and humidity on the adhesion between paper sheet and glass: a molecular dynamics study
