The total elastic stiffness of two contacting bodies with a microscopically rough interface has an interfacial contribution K that is entirely attributable to surface roughness. A quantitative understanding of K is important because it can dominate the total mechanical response and because it is proportional to the interfacial contributions to electrical and thermal conductivity in continuum theory. Numerical simulations of the dependence of K on the applied squeezing pressure p are presented for nominally flat elastic solids with a range of surface roughnesses. Over a wide range of p, K rises linearly with p. Sublinear power-law scaling is observed at small p, but the simulations reveal that this is a finite-size effect. We derive accurate, analytical expressions for the exponents and prefactors of this low-pressure scaling of K by extending the contact mechanics theory of Persson to systems of finite size. In agreement with our simulations, these expressions show that the onset of the low-pressure scaling regime moves to lower pressure as the system size increases.
In this supplementary materials section, we provide (i) additional information on the numerical simulations of the main work, (ii) the derivation of all prefactors in the analytical theory, and (iii) unpublished experiments of the contact stiffness of a polymer pressed against a rough substrate.
We study the distribution of interfacial separations P(u) at the contact region between two elastic solids with randomly rough surfaces. An analytical expression is derived for P(u) using Persson's theory of contact mechanics, and is compared to numerical solutions obtained using (a) a half-space method based on the Boussinesq equation, (b) a Green's function molecular dynamics technique and (c) smart-block classical molecular dynamics. Overall, we find good agreement between all the different approaches.
We investigate interfacial properties between two highly incompatible polymers of different stiffness. The extensive Monte Carlo simulations of the binary polymer melt yield detailed interfacial profiles and the interfacial tension via an analysis of capillary fluctuations. We extract an effective Flory-Huggins parameter from the simulations, which is used in self-consistent field calculations. These take due account of the chain architecture via a partial enumeration of the single chain partition function, using chain conformations obtained by Monte Carlo simulations of the pure phases. The a…
We study the average separation between an elastic solid and a hard solid with a nominal flat but randomly rough surface, as a function of the squeezing pressure. We present experimental results for a silicon rubber (PDMS) block with a flat surface squeezed against an asphalt road surface. The theory shows that an effective repulse pressure act between the surfaces of the form p proportional to exp(-u/u0), where u is the average separation between the surfaces and u0 a constant of order the root-mean-square roughness, in good agreement with the experimental results.
Adhesion between two bodies is a key parameter in wear processes. At the macroscale, strong adhesive bonds are known to lead to high wear rates, as observed in clean metal-on-metal contact. Reducing the strength of the interfacial adhesion is then desirable, and techniques such as lubrication and surface passivation are employed to this end. Still, little is known about the influence of adhesion on the microscopic processes of wear. In particular, the effects of interfacial adhesion on the wear particle size and on the surface roughness evolution are not clear, and are therefore addressed here…
We investigate the effects of roughness and fractality on the normal contact stiffness of rough surfaces. Samples of isotropically roughened aluminium surfaces are considered. The roughness and fractal dimension were altered through blasting using different sized particles. Subsequently, surface mechanical attrition treatment (SMAT) was applied to the surfaces in order to modify the surface at the microscale. The surface topology was characterised by interferometry based profilometry. The normal contact stiffness was measured through nanoindentation with a flat tip utilising the partial unload…
The effective solid liquid interfacial tension (SL IFT) between pure liquids and rough solid surfaces is studied through coarse grained simulations. Using the dissipative particle dynamics method, we design solid liquid interfaces, confining a pure liquid between two explicit solid surfaces with different roughness degrees. The roughness of the solid phase was characterized by Wenzel roughness factor and the effective SL IFT (γ_sl^') is reported as a function of it also. Two solid liquid systems differentiated from each other by their solid liquid repulsion strength are studied to measure the …
I discuss fluid flow at the interface between solids with anisotropic roughness. I show that for randomly rough surfaces with anisotropic roughness, the contact area percolate at the same relative contact area as for isotropic roughness, and that the Bruggeman effective medium theory and the critical junction theory give nearly the same results for the fluid flow conductivity. This shows that, in most cases, the surface roughness observed at high magnification is irrelevant for fluid flow problems such as the leakage of static seals, and fluid squeeze-out.
A combination of fundamental measure density functional theory and Monte Carlo computer simulation is used to determine the orientation-resolved interfacial tension and stiffness for the equilibrium hard-sphere crystal-fluid interface. Microscopic density functional theory is in quantitative agreement with simulations and predicts a tension of 0.66 kT/σ^2 with a small anisotropy of about 0.025 kT and stiffnesses with e.g. 0.53 kT/σ^2 for the (001) orientation and 1.03 kT/σ^2 for the (111) orientation. Here kT is denoting the thermal energy and σthe hard sphere diameter. We compare our results …
The results obtained from molecular dynamics simulations of the friction at an interface between polymer melts and weakly attractive crystalline surfaces are reported. We consider a coarse-grained bead-spring model of linear chains with adjustable intrinsic stiffness. The structure and relaxation dynamics of polymer chains near interfaces are quantified by the radius of gyration and decay of the time autocorrelation function of the first normal mode. We found that the friction coefficient at small slip velocities exhibits a distinct maximum which appears due to shear-induced alignment of semif…
We study a three-dimensional system of self-propelled Brownian particles interacting via the Lennard-Jones potential. Using Brownian Dynamics simulations in an elongated simulation box, we investigate the steady states of vapour-liquid phase coexistence of active Lennard-Jones particles with planar interfaces. We measure the normal and tangential components of the pressure tensor along the direction perpendicular to the interface and verify mechanical equilibrium of the two coexisting phases. In addition, we determine the non-equilibrium interfacial tension by integrating the difference of the…
The adhesive contact between elastic solids with randomly rough, self affine fractal surfaces is studied by molecular dynamics (MD) simulations. The interfacial binding energy obtained from the simulations of nominally flat and curved surfaces is compared with the predictions of the contact mechanics theory by Persson. Theoretical and simulation results agree rather well, and most of the differences observed can be attributed to finite size effects and to the long-range nature of the interaction between the atoms in the block and the substrate in the MD model, as compared to the analytical the…
The logarithmic relation between interfacial separation and squeezing pressure between randomly rough surfaces, has been predicted by both theory and experiment. However, the experimental slope between interfacial separation and logarithmic squeezing pressure, is slightly bigger than that predicted by theory. Here we present a detailed explanation on the slope difference between theory and experiment.
The interfacial stiffness of structure II cyclopentane hydrate in cyclopentane liquid has been measured by the Capillary Wave Fluctuation (CWF) method for an equilibrated system with temperature of T=280K and pressure of P~20bar, close to the upper (L$_w$-Hyd-Vap-L$_{HC}$) Quadruple-point, on the boundary of the hydrate stable region. The hydrate-II/cyclopentane interfacial stiffness results fall broadly in the range $Γ_{ho}$=(35-55)$\times 10^{-3}$J/m$^2$, with an average over all simulations giving $Γ_{ho}$=45(5)$\times 10^{-3}$J/m$^2$. Earlier work of the author has determined the cubic har…
Interfacial roughening denotes the nonequilibrium process by which an initially flat interface reaches its equilibrium state, characterized by the presence of thermally excited capillary waves. Roughening of fluid interfaces has been first analyzed by Flekkoy and Rothman [Phys. Rev. Lett. 75, 260 (1995)], where the dynamic scaling exponents in the weakly damped case in two dimensions were found to agree with the Kardar-Parisi-Zhang universality class. We extend this work by taking into account also the strong-damping regime and perform extensive fluctuating hydrodynamics simulations in two dim…
I study the contact between a rigid solid with a randomly rough surface and an elastic block with a flat surface. I derive a relation between the (average) interfacial separation $u$ and the applied normal squeezing pressure $p$. I show that for non-adhesive inte raction and small applied pressure, p is proportional to exp (-u/u_0), in good agreement with recent experimental observation.
We propose an elasto-plastic inspired friction model which incorporates interfacial stiffness. Steady state sliding friction is characterized by a generic nonmonotonic behavior, including both velocity weakening and strengthening branches. In 1D and upon the application of sideway loading, we demonstrate the existence of transient cracklike fronts whose velocity is independent of sound speed, which we propose to be analogous to the recently discovered slow interfacial rupture fronts. Most importantly, the properties of these transient inhomogeneously loaded fronts are determined by steady stat…
We study the adhesive contact between elastic solids with randomly rough, self affine fractal surfaces. We present molecular dynamics (MD) simulation results for the interfacial stress distribution and the wall-wall separation. We compare the MD results for the relative contact area and the average interfacial separation, with the prediction of the contact mechanics theory of Persson. We find good agreement between theory and the simulation results. We apply the theory to the system studied by Benz et al. involving polymer in contact with polymer, but in this case the adhesion gives only a sma…
We report a molecular dynamics study of the contact between a rigid solid with a randomly rough surface and an elastic block with a flat surface. We study the contact area and the interfacial separation from small contact (low load) to full contact (high load). For small load the contact area varies linearly with the load and the interfacial separation depends logarithmically on the load. For high load the contact area approaches to the nominal contact area (i.e., complete contact), and the interfacial separation approaches to zero. The present results may be very important for soft solids, e.…
We present a molecular dynamics study of the contact between a rigid solid with a randomly rough surface and an elastic block with a flat surface. The numerical calculations mainly focus on the contact area and the interfacial separation from small contact (low load) to full contact (high load). For small load the contact area varies linearly with the load and the interfacial separation depends logarithmically on the load. For high load the contact area approaches the nominal contact area (i.e., complete contact), and the interfacial separation approaches zero. The numerical results have been …
Eshelby's theory is the foundation of composite mechanics, allowing calculation of the effective elastic moduli of composites from a knowledge of their microstructure. However it ignores interfacial stress and only applies to very dilute composites -- i.e. where any inclusions are widely spaced apart. Here, within the framework of the Mori-Tanaka multiphase approximation scheme, we extend Eshelby's theory to treat a composite with interfacial stress in the non-dilute limit. In particular we calculate the elastic moduli of composites comprised of a compliant, elastic solid hosting a non-dilute …
We study the time dependency of the (average) interfacial separation between an elastic solid with a flat surface and a rigid solid with a randomly rough surface, squeezed together in a fluid. We use an analytical theory describing the fluid flow factors, based on the Persson contact mechanics theory and the Bruggeman effective medium theory, to calculate the removal of the fluid from the contacting interface of the two solids. In order to test this approach, we have performed simple squeeze-out experiments. The experimental results are compared to the theory predictions.
We generalize the Persson contact mechanics and rubber friction theory to the case where both surfaces have surface roughness. The solids can be rigid, elastic or viscoelastic, and can be homogeneous or layered. We calculate the contact area, the viscoelastic contribution to the friction force, and the average interfacial separation as a function of the sliding speed and the nominal contact pressure. We illustrate the theory with numerical results for a rubber block sliding on a road surface. We find that with increasing sliding speed, the influence of the roughness on the rubber block decreas…
The description of elastic, nonadhesive contacts between solids with self-affine surface roughness seems to necessitate knowledge of a large number of parameters. However, few parameters suffice to determine many important interfacial properties as we show by combining dimensional analysis with numerical simulations. This insight is used to deduce the pressure dependence of the relative contact area and the mean interfacial separation $Δ\bar{u}$ and to present the results in a compact form. Given a proper unit choice for pressure $p$, i.e., effective modulus $E^*$ times the root-mean-square gr…
Field-theoretical approach to estimate mean gap and gap distribution in randomly rough surface contact mechanics
Yangzhou University（扬州大学）；Institute of Mechanics, Chinese Academy of Sciences（中国科学院力学研究所）；University of Chinese Academy of Sciences（中国科学院大学）；Hefei University of Technology（合肥工业大学）
I study fluid flow at the interface between elastic solids with randomly rough surfaces. I use the contact mechanics model of Persson to take into account the elastic interaction between the solid walls and the Bruggeman effective medium theory to account for the influence of the disorder on the fluid flow. I calculate the flow tensor which determines the pressure flow factor and, e.g., the leak-rate of static seals. I show how the perturbation treatment of Tripp can be extended to arbitrary order in the ratio between the root-mean-square roughness amplitude and the average interfacial surface…
We study the heat transfer between elastic solids with randomly rough surfaces. We include both the heat transfer from the area of real contact, and the heat transfer between the surfaces in the noncontact regions. We apply a recently developed contact mechanics theory, which accounts for the hierarchical nature of the contact between solids with roughness on many different length scales. For elastic contact, at the highest (atomic) resolution the area of real contact typically consists of atomic (nanometer) sized regions, and we discuss the implications of this for the heat transfer. For soli…
Nematic liquid crystals at rough and fluctuating interfaces are analyzed within the Frank elastic theory and the Landau-de Gennes theory. We study specifically interfaces that locally favor planar anchoring. In the first part we reconsider the phenomenon of Berreman anchoring on fixed rough surfaces, and derive new simple expressions for the corresponding azimuthal anchoring energy. Surprisingly, we find that for strongly aligning surfaces, it depends only on the geometrical surface anisotropy and the bulk elastic constants, and not on the precise values of the chemical surface parameters. In …
State Key Laboratory of Solid Lubrication, Lanzhou Institute of Chemical Physics, Chinese Academy of Sciences（中国科学院兰州化学物理研究所固体润滑国家重点实验室）；Peter Grünberg Institute (PGI-1), Forschungszentrum Jülich（于利希研究中心彼得·格林伯格研究所（PGI-1））；MultiscaleConsulting（多尺度咨询公司）
I study how the contact area and the work of adhesion, between two elastic solids with randomly rough surfaces, depend on the relative humidity. The surfaces are assumed to be hydrophilic, and capillary bridges form at the interface between the solids. For elastically hard solids with relative smooth surfaces, the area of real contact and therefore also the sliding friction, are maximal when there is just enough liquid to fill out the interfacial space between the solids, which typically occurs for $d_{\rm K} \approx 3 h_{\rm rms}$, where $d_{\rm K}$ is the height of the capillary bridge and $…
We present a newly developed approach for the calculation of interfacial stiffness and contact area evolution between two rough bodies exhibiting self affine surface structures. Using spline assisted discretization to define localised contact normals and surface curvatures we interpret the mechanics of simulated non-adhesive elastic surface-profiles subjected to normal loading by examining discrete contact points as projected Hertzian spheres. The analysis of rough-to-rough contact mechanics for surface profiles exhibiting fractal structures, with fractal dimensions in the regime 1 2, reveals …
When adhesive elastomeric materials slide over hard rough surfaces at low velocities, there are two primary dissipative mechanisms that control how friction changes with sliding velocity: viscoelastic dissipation and adhesive dissipation. To distinguish the contribution of these dissipative mechanisms we have measured frictional shear stresses for crosslinked polydimethylsiloxane (PDMS) on three different rough surfaces of similar surface chemistry across nearly six decades of sliding velocity. The results show that the observed friction is dominated by adhesive dissipation, rather than viscoe…
We introduce an accurate and efficient method for characterizing surface wetting and interfacial properties, such as the contact angle made by a liquid droplet on a solid surface, and the vapor-liquid surface tension of a fluid. The method makes use of molecular simulations in conjunction with the indirect umbrella sampling technique to systematically wet the surface and estimate the corresponding free energy. To illustrate the method, we study the wetting of a family of Lennard-Jones surfaces by water. We estimate contact angles for surfaces with a wide range of attractions for water by using…
Dynamic wetting plays an important role in the physics of multiphase flow, and has significant influence on many industrial and geotechnical applications. In this work, a modified smoothed particle hydrodynamics (SPH) model is employed to simulate surface tension, contact angle, and dynamic wetting effects. The wetting and dewetting phenomena are simulated in a capillary tube, where the liquid particles are raised or withdrawn by a shifting substrate. The SPH model is modified by introducing a newly-developed viscous force formulation at liquid-solid interface to reproduce the rate-dependent b…
We use molecular simulations to study the nonadhesive and adhesive atomic-scale contact of rough spheres with radii ranging from nanometers to micrometers over more than ten orders of magnitude in applied normal load. At the lowest loads, the interfacial mechanics is governed by the contact mechanics of the first asperity that touches. The dependence of contact area on normal force becomes linear at intermediate loads and crosses over to Hertzian at the largest loads. By combining theories for the limiting cases of nominally flat rough surfaces and smooth spheres, we provide parameter-free ana…
True contact between randomly rough solids consists of myriad individual micro-junctions. While their total area controls the adhesive friction force of the interface, other macroscopic features, including viscoelastic friction, wear, stiffness and electric resistance, also strongly depend on the size and shape of individual micro-junctions. Here we show that, in rough elastomer contacts, the shape of micro-junctions significantly varies as a function of the shear force applied to the interface. This process leads to a growth of anisotropy of the overall contact interface, which saturates in m…
