Significantly Affected Lubrication Behavior of Silicone Oil Lubricated Si3N4/Glass Contact after Cleaning with Different Solvents.

Conventional methyl silicone oils have poor lubricating properties in boundary lubrication regions, particularly for ceramic/oxide point contact lubrication. In this study, the residues of various organic solvents on the surfaces of Si3N4 spheres/glass disks were used to determine their effect on the lubricating properties of silicone oil 200. The minute ethanol residues significantly enhanced the antifriction and antiwear properties of silicone oil. Compared to the blank sample, the coefficient of friction (COF) and wear volume of silicone oil 200 with the residual ethanol friction pair were reduced by >40% and >98%, respectively. Being immiscible with silicone oil, the minute ethanol residues also removed impurities from the glass surface and maintained a clean interface, thus effectively blocking direct interactions between the friction pair interfaces. In addition, the residual ethanol reduced the atomic force microscope probe-to-glass surface adhesive force in the silicone oil 200 environment, thus allowing it to maintain low COF and wear rates over a broader range of speeds, loads, and times. In contrast to previous work, this study is the first to effectively regulate the lubrication properties of silicone oil using a residual organic solvent. The findings further verified that the adsorption of vapor molecules can significantly alter the surface forces between interfaces. Thus, adjusting the adhesion force through trace amounts of organic solvent residues may provide novel research inputs, thereby guiding the expansion and scope of silicone oil lubrication applications.

High-Temperature Superlubricity Realized with Chlorinated-Phenyl and Methyl-Terminated Silicone Oil and Hydrogen-Ion Running-in.

Ceramic friction pairs lubricated with chlorinated-phenyl and methyl-terminated silicone oil (CPSO) systems have potential applications in the aerospace industry. In this study, the effects of the running-in process and temperature on the lubricating performance of CPSO were investigated. The superlubricity of Si3N4/sapphire lubricated with CPSO was realized at >190 °C after H+-ion running-in. The mechanism of this high-temperature superlubricity was investigated by determining the stable adsorption configurations and adsorption energies of CPSO on different surfaces using density functional theory calculations. Compared with that on the Si3N4 surface, the adsorption capacity of CPSO on the hydroxylated SiO2 surface generated by H+-ion running-in increased, whereas the steric hindrance decreased. The viscosity-temperature curve of CPSO was measured, wherein the viscosity and pressure-viscosity coefficient of CPSO considerably decreased with increasing temperature, leading to high-temperature superlubricity in a wide speed/load range. This is the first paper to report oil-based superlubricity at temperatures of 190 °C, or even higher-temperature conditions. Furthermore, it provides guidance for the use of ceramic-CPSO systems in high-temperature conditions, including in the aerospace industry.

Exploring the Evolution Mechanism of Sulfur Vacancies by Investigating the Role of Vacancy Defects in the Interaction between H2S and the FeS(001) Surface.

Vacancy defects are inherent point defects in materials. In this study, we investigate the role of Fe vacancy (VFe) and S vacancy (VS) in the interaction (adsorption, dissociation, and diffusion) between H2S and the FeS(001) surface using the dispersion-corrected density functional theory (DFT-D2) method. VFe promotes the dissociation of H2S but slightly hinders the dissociation of HS. Compared with the perfect surface (2.08 and 1.15 eV), the dissociation energy barrier of H2S is reduced to 1.56 eV, and HS is increased to 1.25 eV. Meanwhile, S vacancy (VS) significantly facilitates the adsorption and dissociation of H2S, which not only reduces the dissociation energy barriers of H2S and HS to 0.07 and 0.11 eV, respectively, but also changes the dissociation process of H2S from an endothermic process to a spontaneous exothermic one. Furthermore, VFe can promote the hydrogen (H) diffusion process from the surface into the matrix and reduce the energy barrier of the rate-limiting step from 1.12 to 0.26 eV. But it is very hard for H atoms gathered around VS to diffuse into the matrix, especially the energy barrier of the rate-limiting step increases to 1.89 eV. Finally, we propose that VS on the FeS(001) surface is intensely difficult to form and exist in the actual environment through the calculation results.

Effect of Impurity Atoms on the Adsorption/Dissociation of Hydrogen Sulfide and Hydrogen Diffusion on the Fe(100) Surface.

In the actual environment, impurity atoms significantly affect the adsorption/dissociation of gas molecules on the substrate surface and in turn promote or impede the formation of subsequent products. In this study, we investigate the effects of three kinds of impurity atoms (H, O, and S) on the adsorption/dissociation of hydrogen sulfide (H2S) and hydrogen (H) diffusion processes by using the density functional theory method. We found that impurity atoms can change the charge density distribution of the surface and thus affect the adsorption/dissociation process of H2S. The existence of a H atom reduces the dissociation barrier of H2S. The adsorption site of H2S near the O atom is transferred from the bridge site to the adjacent top site and the first-order dissociation barrier of H2S is 0.07 eV, which is prominently lower than that of the pristine surface (0.28 eV). The presence of a S atom transfers the adsorption site of H2S to a farther bridge site and effectively affects the dissociation process of H2S. Both O and S atoms hinder the dissociation process of HS. Moreover, the diffusion process of H atoms to the subsurface can be slightly impeded by the O atom. Our work theoretically explains the influence mechanism of impurity atoms on the adsorption/dissociation of H2S and H diffusion behavior on the Fe(100) surface.

Highly efficient adsorption and mechanism of alkylphenols on magnetic reduced graphene oxide.

The influence of alkylphenols to environment cannot be ignored, as they are common product from chemical industries and potential threat to human health. Some alkylphenols are listed as persistent toxic substances (PTS) by the United Nations Environment Programme (UNEP). In this study, the optimized magnetic reduced graphene oxide (MrGO) was synthesized by a facile solvothermal method, and investigated for adsorption of three typical alkylphenols. In neutral condition, MrGO showed extremely high adsorption capacity of three typical alkylphenols, 4-heptylphenol (4-HP), 4-tert-octylphenol (4-OP), and 4-nonylphenol (4-NP), which could reach 938.9 mg g-1 (40 °C), 987.8 mg g-1 (40 °C), and 989.7 mg g-1 (20 °C), respectively. This study revealed that the adsorption process was a heterogeneous multi-layer physical adsorption, and the adsorption rates were related to the number of unoccupied vacancies on the adsorbent surface. From batch experiments and density functional theory (DFT) calculations, the main adsorption interactions between MrGO and alkylphenols were deduced to be π-π, hydrogen-bond, and hydrophobic interactions. What's more, the different affinities of MrGO towards different targets were further distinguished and explained in detail. The wonderful stability and recyclability of MrGO made it a promising cost-effective remediation candidate.

Effects of Abrasive Particles on Liquid Superlubricity and Mechanisms for Their Removal.

Liquid superlubricity results in a near-frictionless lubrication state, which can greatly reduce friction and wear under aqueous conditions. However, during the running-in process, a large number of abrasive particles are generated, and because these may lead to a breakdown in superlubricity performance, they should be effectively removed. In this paper, the morphology, size, and composition of abrasive particles were verified using scanning electron microscopy with energy-dispersive X-ray spectroscopy, and their influence on liquid superlubricity was explored through friction tests. Subsequently, different solvents were used to remove the abrasive particles, and the optimal cleaning process was determined by macroscopic tribo-tests and microscopic analysis. Finally, droplet-spreading experiments and a force-curve analysis were carried out to understand the abrasive-particle removal mechanism by different solvents. We found that SiO2 was the main component in the abrasive particles, and micron-sized SiO2 particles resulted in random "wave peaks" in the coefficient of friction and, thus, the superlubricity. Absolute ethanol + ultrapure water was determined to be the optimal solvent for effectively removing abrasive particles from friction-pair surfaces and helped the lubricant in exhibiting an ultralow friction coefficient for long periods of time. We proposed a "wedge" and "wrap" model to explain the abrasive-particle removal mechanism of different solvents. The SiO2 removal mechanism outlined in this study can be applied under aqueous conditions to improve the stability and durability of liquid superlubricity in practical engineering applications.

Superlow Wear Realizable Tribofilms from Lubricant Oil Containing Hydrothermally Synthesized Magnesium Silicate Hydroxide/Carbon Core-Shell Nanoplates.

This paper reports on the hydrothermal synthesis of a novel 2D material, magnesium silicate hydroxide/carbon (MSH/C) core-shell nanoplate, in a graphite-MgO-SiO2-NaOH system at 300 °C and 12 MPa for 48 h. Its significant potentials as an antiwear additive in lubricant oil were subsequently demonstrated. The 2D nanoplates consist of an MSH core and a 1-6 nm thick sp2-hybridized carbon shell with a layer spacing of 0.34 nm. In typical four-ball tests at a maximum Hertzian pressure of 3.4 GPa, the MSH/C core-shell nanoplates nearly eliminated wear, whether suspended in poly alpha-olefin oil or fully formulated lubricating oil, and the corresponding volume wear rates were reduced by 96.33% and 72%, respectively. The excellent antiwear performance was ascribed to the formation of a tribofilm consisting of diffusedly distributed Fe3O4 nanocrystals and carbon- and/or SiOx-containing amorphous structures.