Effect of flow-induced molecular alignment on welding and strength of polymer interfaces

TL;DR

This study uses molecular simulations to investigate how flow-induced molecular alignment affects welding and strength in polymer interfaces, revealing that alignment weakens the material near welds but does not alter diffusion or entanglement formation rates.

Contribution

It demonstrates through simulations that molecular alignment does not change diffusion rates but weakens the material near welds, impacting mechanical strength.

Findings

Aligned materials are weaker near welds initially.

Diffusion rates across interfaces are unaffected by alignment.

Maximum shear strength matches that of unaligned bulk materials.

Abstract

Structures formed by fused filament fabrication are often substantially weaker than those made with conventional techniques, and fail at the welds between successive layers. One factor that may influence strength is flow-induced alignment of deposited material. Recent work suggests that alignment reduces the entanglement density and thus should accelerate welding by diffusion. Here, coarse-grained molecular simulations are used to test the effect of molecular alignment on diffusion and weld strength. While standard measures show a decrease of the entanglement density with alignment, there is no change in the rate of diffusion normal to the interface or the rate of formation of entanglements across the interface. The time for chain reorientation also remains equal to the equilibrium disentanglement time $\tau_d$. Despite this, simulations of mechanical tests show that welds formed from aligned states are weaker until several $\tau_d$. This is not because the weld itself is weaker, but because aligned material near the weld is weaker than unaligned material. The maximum shear strength and tensile fracture energy of welded systems are the same as bulk systems with the same alignment.