Is Ultralow Friction on Graphite Sustainable in Contaminated Environments?

Fuente: arXiv
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Autori principali: Gao, Hongyu, Sukhomlinov, Sergey
Natura: Preprint
Pubblicazione: 2024
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author Gao, Hongyu
Sukhomlinov, Sergey
author_facet Gao, Hongyu
Sukhomlinov, Sergey
contents Structural lubricity arises typically at incommensurate, well-defined dry contacts where short-range elastic instability is significantly mitigated. However, under ambient conditions, airborne molecules adsorb onto solid surfaces, forming an intervening viscous medium that alters interfacial properties. Using molecular dynamics simulations with a newly parameterized interfacial potential, we investigate the preservation of ultralow friction on graphite with physisorbed n-hexadecane (HEX) as a model contaminant. Our findings reveal that a well-ordered monolayer of HEX molecules strongly adheres to the graphite surface, replicating its lattice structure and maintaining solid-like behavior, which leads to orientation-dependent shear stresses-an effect absent on a gold (111) surface. As the contaminant film thickens, this orientation effect diminishes. Additionally, as coverage increases from zero to one monolayer, the shear stress-velocity relationship transitions from Coulomb to quasi-Stokesian and then to quasi-Coulomb, highlighting the role of molecular displacement in high-velocity dissipation. Despite a hundredfold increase in shear stress compared to dry sliding, superlubricity on graphite persists under ambient conditions, enhancing our conventional understanding of structural lubricity.
format Preprint
id arxiv_https___arxiv_org_abs_2408_16677
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle Is Ultralow Friction on Graphite Sustainable in Contaminated Environments?
Gao, Hongyu
Sukhomlinov, Sergey
Materials Science
Structural lubricity arises typically at incommensurate, well-defined dry contacts where short-range elastic instability is significantly mitigated. However, under ambient conditions, airborne molecules adsorb onto solid surfaces, forming an intervening viscous medium that alters interfacial properties. Using molecular dynamics simulations with a newly parameterized interfacial potential, we investigate the preservation of ultralow friction on graphite with physisorbed n-hexadecane (HEX) as a model contaminant. Our findings reveal that a well-ordered monolayer of HEX molecules strongly adheres to the graphite surface, replicating its lattice structure and maintaining solid-like behavior, which leads to orientation-dependent shear stresses-an effect absent on a gold (111) surface. As the contaminant film thickens, this orientation effect diminishes. Additionally, as coverage increases from zero to one monolayer, the shear stress-velocity relationship transitions from Coulomb to quasi-Stokesian and then to quasi-Coulomb, highlighting the role of molecular displacement in high-velocity dissipation. Despite a hundredfold increase in shear stress compared to dry sliding, superlubricity on graphite persists under ambient conditions, enhancing our conventional understanding of structural lubricity.
title Is Ultralow Friction on Graphite Sustainable in Contaminated Environments?
topic Materials Science
url https://arxiv.org/abs/2408.16677