Influence of anionic alkyl chain on the tribological properties of titanium alloy under water lubrication: Experimental analysis and molecular dynamics simulations.

Abstract

In this work, four types of protic ionic liquids were prepared for use as pure water additives to investigate the effect of anionic alkyl chains on the tribological and drilling performance of a titanium alloy. Copper block immersion tests and electrochemical tests were conducted to compare their corrosion resistance. The results indicate that the ionic liquid containing OH and CC in the anionic alkyl chain led to stronger adsorption onto the metal substrate, providing excellent tribological performance and the highest corrosion inhibition rate (η = 98.45 %). According to density functional theory, wear scar surface analysis, and molecular dynamics simulation, the low energy gap of the anion (ΔE = 0.033 Ha) indicated that it exhibited higher reactivity. Thus, it was more susceptible to frictional chemical reactions with the metal substrate under the action of frictional heat during shearing, ultimately forming a friction film with a thickness of 20-97 nm. The ionic liquid demonstrated good wetting properties in a drilling test, enabling its effective penetration into the gaps between the drill bit and the workpiece to achieve lubrication and cooling effects. Thus, the axial force and drilling temperature were significantly reduced. Additionally, biotoxicity tests indicated that the ionic liquid is an environmentally friendly substance.