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Showing papers on "Surface tension published in 2018"


Journal ArticleDOI
TL;DR: A bottom-up approach to prepare super-repellent coatings using a mixture of fluorosilanes and cyanoacrylate is reported, which are transparent, durable and demonstrate universal liquid bouncing, tailored responsiveness and anti-freezing properties.
Abstract: High-performance coatings that durably and fully repel liquids are of interest for fundamental research and practical applications. Such coatings should allow for droplet beading, roll off and bouncing, which is difficult to achieve for ultralow surface tension liquids. Here we report a bottom-up approach to prepare super-repellent coatings using a mixture of fluorosilanes and cyanoacrylate. On application to surfaces, the coatings assemble into thin films of locally multi-re-entrant hierarchical structures with very low surface energies. The resulting materials are super-repellent to solvents, acids and bases, polymer solutions and ultralow surface tension liquids, characterized by ultrahigh liquid contact angles (>150°) and negligible roll-off angles (~0°). Furthermore, the coatings are transparent, durable and demonstrate universal liquid bouncing, tailored responsiveness and anti-freezing properties, and are thus a promising alternative to existing synthetic super-repellent coatings.

251 citations


Journal ArticleDOI
TL;DR: In this paper, a review of different scaling parameters and characteristic lengths involved in elastocapillarity is presented, focusing on three main configurations, each characterized by a specific dimension: three-dimensional (3D), deformations induced in bulk solids; 1D, bending and bundling of rod-like structures;...
Abstract: Although negligible at large scales, capillary forces may become dominant for submillimetric objects. Surface tension is usually associated with the spherical shape of small droplets and bubbles, wetting phenomena, imbibition, or the motion of insects at the surface of water. However, beyond liquid interfaces, capillary forces can also deform solid bodies in their bulk, as observed in recent experiments with very soft gels. Capillary interactions, which are responsible for the cohesion of sandcastles, can also bend slender structures and induce the bundling of arrays of fibers. Thin sheets can spontaneously wrap liquid droplets within the limit of the constraints dictated by differential geometry. This review aims to describe the different scaling parameters and characteristic lengths involved in elastocapillarity. We focus on three main configurations, each characterized by a specific dimension: three-dimensional (3D), deformations induced in bulk solids; 1D, bending and bundling of rod-like structures; ...

202 citations


Journal ArticleDOI
TL;DR: In this paper, stable oil-in-water nano-emulsions using nonionic surfactant (Tween 40) and light mineral oil for their application in enhanced oil recovery.
Abstract: Nanoemulsions are kinetically stable biphasic dispersion of two immiscible liquids typically stabilized by an emulsifier with droplet sizes in the range of 10–200 nm. Present work deals with the formulation and characterization of stable oil-in-water nanoemulsions using nonionic surfactant (Tween 40) and light mineral oil for their application in enhanced oil recovery. The stability study of the nanoemulsions formed by high energy and low energy method was accomplished by bottle testing method. The emulsions were characterized in terms of droplet size, morphology and inner structure, surface charge, interfacial tension, and rheology. Droplet sizes of 18–31 nm obtained by dynamic light scattering analysis and surface charge values above −35 mV obtained by ζ potential measurement prove the higher kinetic stability of the formed emulsions. Cryo-TEM micrographs reveal the surface morphology and inner structure of nanoemulsions. A miscibility test was performed to determine the dissolving ability of the nanoem...

159 citations


Journal ArticleDOI
TL;DR: Direct time-resolved imaging of melt pool flow dynamics from a high-energy synchrotron radiation experiment is presented to show surface tension affects flow speed, orientation and surface turbulence.
Abstract: Internal flow behaviour during melt-pool-based metal manufacturing remains unclear and hinders progression to process optimisation. In this contribution, we present direct time-resolved imaging of melt pool flow dynamics from a high-energy synchrotron radiation experiment. We track internal flow streams during arc welding of steel and measure instantaneous flow velocities ranging from 0.1 m s−1 to 0.5 m s−1. When the temperature-dependent surface tension coefficient is negative, bulk turbulence is the main flow mechanism and the critical velocity for surface turbulence is below the limits identified in previous theoretical studies. When the alloy exhibits a positive temperature-dependent surface tension coefficient, surface turbulence occurs and derisory oxides can be entrapped within the subsequent solid as result of higher flow velocities. The widely used arc welding and the emerging arc additive manufacturing routes can be optimised by controlling internal melt flow through adjusting surface active elements. Understanding what happens to the liquid in melt pools during welding and metal-based additive manufacturing remains a challenge. Here, the authors directly image internal melt pool dynamics using synchrotron radiation to show surface tension affects flow speed, orientation and surface turbulence.

156 citations


Journal ArticleDOI
TL;DR: In this paper, a three-dimensional high-fidelity model was developed to simulate the single track formation of stainless steel 316L during selective laser melting, revealing the underlying physics of porosity development during the melting and solidification process.

146 citations


Journal ArticleDOI
TL;DR: Triply re-entrant structures, possessing superrepellence to water and various organic liquids, are fabricated via two-photon polymerization based 3D printing technology and can find potential applications in electronic devices, gas sensors, microchemical/physical reactors, high-throughput biological sensors, and optical displays.
Abstract: Bioinspired re-entrant structures have been proved to be effective in achieving liquid superrepellence (including anti-penetration, anti-adhesion, and anti-spreading). However, except for a few reports relying on isotropic etching of silicon wafers, most fluorination-dependent surfaces are still unable to repel liquids with extreme low surface energy (i.e., γ < 15 mN m-1 ), especially those fluorinated solvents. Herein, triply re-entrant structures, possessing superrepellence to water (with surface tension γ of 72.8 mN m-1 ) and various organic liquids (γ = 12.0-27.1 mN m-1 ), are fabricated via two-photon polymerization based 3D printing technology. Such structures can be constructed both on rigid and flexible substrates, and the liquid superrepellent properties can be kept even after oxygen plasma treatment. Based on the prepared triply re-entrant structures, micro open capillaries are constructed on them to realize directional liquid spreading, which may be applied in microfluidic platforms and lab-on-a-chip applications. The fabricated arrays can also find potential applications in electronic devices, gas sensors, microchemical/physical reactors, high-throughput biological sensors, and optical displays.

140 citations


Journal ArticleDOI
27 Dec 2018-Polymers
TL;DR: This study provides the guidelines to verify the surface free energy decrease with the fiber fraction for the meshes, to validate the changes in wetting contact angles and suggested that meshes could maintain the entrapped air between fibers, decreasing surface free energies for polymers.
Abstract: Wettability of electrospun fibers is one of the key parameters in the biomedical and filtration industry. Within this comprehensive study of contact angles on three-dimensional (3D) meshes made of electrospun fibers and films, from seven types of polymers, we clearly indicated the importance of roughness analysis. Surface chemistry was analyzed with X-ray photoelectron microscopy (XPS) and it showed no significant difference between fibers and films, confirming that the hydrophobic properties of the surfaces can be enhanced by just roughness without any chemical treatment. The surface geometry was determining factor in wetting contact angle analysis on electrospun meshes. We noted that it was very important how the geometry of electrospun surfaces was validated. The commonly used fiber diameter was not necessarily a convincing parameter unless it was correlated with the surface roughness or fraction of fibers or pores. Importantly, this study provides the guidelines to verify the surface free energy decrease with the fiber fraction for the meshes, to validate the changes in wetting contact angles. Eventually, the analysis suggested that meshes could maintain the entrapped air between fibers, decreasing surface free energies for polymers, which increased the contact angle for liquids with surface tension above the critical Wenzel level to maintain the Cassie-Baxter regime for hydrophobic surfaces.

139 citations


Journal ArticleDOI
TL;DR: In this paper, the mechanism and relief method of coal seam water blocking effect (WBE) to improve the efficiency of gas drainage, the causes and the influencing factors of the coal seam WBE are analyzed, and the critical micelle concentration (CMC), surface tension, viscosity and contact angle changes of the surfactants on the surface of coal are investigated.

130 citations


Journal ArticleDOI
TL;DR: A general, efficient strategy for large-area 2DMCs that grows crystals on water surface to minimize the density of nuclei by controlling the interfacial tension of the water/solution system with a phase transfer surfactant.
Abstract: Two-dimensional molecular crystals (2DMCs) are a promising candidate for flexible and large-area electronics. Their large-area production requires both low nuclei density and 2D crystal growth mode. As an emerging type of material, their large-area production remains a case-by-case practice. Here we present a general, efficient strategy for large-area 2DMCs. The method grows crystals on water surface to minimize the density of nuclei. By controlling the interfacial tension of the water/solution system with a phase transfer surfactant, the spreading area of the solvent increases tens of times, leading to the space-confined 2D growth of molecular crystals. As-grown sub-centimeter-sized 2DMCs floating on the water surface can be easily transferred to arbitrary substrates for device applications.

124 citations


Journal ArticleDOI
TL;DR: An omniphobic membrane was fabricated for membrane distillation by effectively depositing ZnO nanoparticles on a hydrophilic glass fiber (GF) membrane using a chemical bath deposition method to create hierarchical reentrant structures, followed by surface fluorination and the addition of a polymer coating to lower the surface energy as mentioned in this paper.

120 citations


Journal ArticleDOI
TL;DR: Experimental measurements of heat transfer performance during hydrocarbon condensation on a LIS enhances heat transfer by ≈450% compared to an uncoated surface, and a failure mechanism whereby shedding droplets depleted the lubricant over time is highlighted.
Abstract: Vapor condensation is routinely used as an effective means of transferring heat or separating fluids. Dropwise condensation, where discrete droplets form on the condenser surface, offers a potential improvement in heat transfer of up to an order of magnitude compared to filmwise condensation, where a liquid film covers the surface. Low surface tension fluid condensates such as hydrocarbons pose a unique challenge since typical hydrophobic condenser coatings used to promote dropwise condensation of water often do not repel fluids with lower surface tensions. Recent work has shown that lubricant infused surfaces (LIS) can promote droplet formation of hydrocarbons. In this work, we confirm the effectiveness of LIS in promoting dropwise condensation by providing experimental measurements of heat transfer performance during hydrocarbon condensation on a LIS, which enhances heat transfer by ≈450% compared to an uncoated surface. We also explored improvement through removal of noncondensable gases and highlighted a failure mechanism whereby shedding droplets depleted the lubricant over time. Enhanced condensation heat transfer for low surface tension fluids on LIS presents the opportunity for significant energy savings in natural gas processing as well as improvements in thermal management, heating and cooling, and power generation.

Journal ArticleDOI
TL;DR: In this article, a 3D multi-phase model of PEMFC is developed, in which the Eulerian-Eulerian model is utilized to solve the gas and liquid two-phase flow in channels, while the two-fluid model is adopted in porous electrodes.

Journal ArticleDOI
TL;DR: It is found that PGL-3 droplets are predominantly viscous but also exhibit elastic properties as the salt concentration is reduced, their elastic modulus, viscosity, and surface tension increase.
Abstract: An increasing number of proteins with intrinsically disordered domains have been shown to phase separate in buffer to form liquidlike phases. These protein condensates serve as simple models for the investigation of the more complex membraneless organelles in cells. To understand the function of such proteins in cells, the material properties of the condensates they form are important. However, these material properties are not well understood. Here, we develop a novel method based on optical traps to study the frequency-dependent rheology and the surface tension of P-granule protein PGL-3 condensates as a function of salt concentration. We find that PGL-3 droplets are predominantly viscous but also exhibit elastic properties. As the salt concentration is reduced, their elastic modulus, viscosity, and surface tension increase. Our findings show that salt concentration has a strong influence on the rheology and dynamics of protein condensates suggesting an important role of electrostatic interactions for their material properties.

Journal ArticleDOI
TL;DR: In this article, a review on the effect of nanoparticles and base fluid nature, temperature, use of surfactant, nanoparticle concentration, size and shape as well on the surface tension and wettability of nanofluids is presented.
Abstract: Nanofluids are recent nanomaterials with improved thermophysical properties that could enhance the efficiency and reliability of heat transfer systems. Relevant properties for heat transfer calculation, thin film flows, droplet impingements or microfluidic are surface tension and wettability. However, to date, the understanding of those properties in nanofluids field is at the beginning compared to transport properties. At this stage, this review focus on the effect of nanoparticles and base fluid nature, temperature, use of surfactant, nanoparticle concentration, size and shape as well on the surface tension and wettability of nanofluids. After the presentation of heat transfer processes involving the influence of surface tension and wettability, this paper is organized according to the nature of the nanoparticles dealing with oxide, carbon-based and metallic nanofluids as well as unusual or less considered nature of nanoparticles. The factors affecting the surface tension of nanofluids are relatively well identified, but concentration and surfactant effects present some inconsistent outcomes. In any case, the dispersion of nanoparticles have an effect on the surface tension of base fluid significantly lower than that on transport properties. Based on results available in the literature and existing empirical correlations, a comprehensive assessment, challenges and future works are suggested.

Journal ArticleDOI
TL;DR: This work uses a simple and passive technique consisting of superomniphobic surfaces with a macrotexture (comparable to the droplet size) to experimentally demonstrate coalescence-induced jumping with an energy conversion efficiency of 18.8% and demonstrates the first-ever demonstration of coalesced droplet jumping at Ohnesorge number >1.
Abstract: When two liquid droplets coalesce on a superrepellent surface, the excess surface energy is partly converted to upward kinetic energy, and the coalesced droplet jumps away from the surface. However, the efficiency of this energy conversion is very low. In this work, we used a simple and passive technique consisting of superomniphobic surfaces with a macrotexture (comparable to the droplet size) to experimentally demonstrate coalescence-induced jumping with an energy conversion efficiency of 18.8% (i.e., about 570% increase compared to superomniphobic surfaces without a macrotexture). The higher energy conversion efficiency arises primarily from the effective redirection of in-plane velocity vectors to out-of-plane velocity vectors by the macrotexture. Using this higher energy conversion efficiency, we demonstrated coalescence-induced jumping of droplets with low surface tension (26.6 mN m−1) and very high viscosity (220 mPa·s). These results constitute the first-ever demonstration of coalescence-induced jumping of droplets at Ohnesorge number >1.

Journal ArticleDOI
TL;DR: A remarkable correlation was obtained between the evaluated interaction force data and the fouling behavior of the membranes with different surface energy, indicating that membranes with low surface energy have a higher fouling potential than membranes with high or ultralow surface energy.
Abstract: This study investigates the fouling mechanisms in membrane distillation, focusing on the impact of foulant type and membrane surface chemistry. Interaction forces between a surface-functionalized particle probe simulating a range of organic foulants and model surfaces, modified with different surface energy materials, were measured by atomic force microscopy. The measured interaction forces were compared to those calculated based on the experimentally determined surface energy components of the particle probe, model surface, and medium (i.e., water). Surfaces with low interfacial energy exhibited high attractive interaction forces with organic foulants, implying a higher fouling potential. In contrast, hydrophilic surfaces (i.e., surfaces with high interfacial energy) showed the lowest attractive forces with all types of foulants. We further performed fouling experiments with alginate, humic acid, and mineral oil in direct contact membrane distillation using polyvinylidene fluoride membranes modified with various materials to control membrane surface energy. The observed fouling behavior was compared to the interaction force data to better understand the underlying fouling mechanisms. A remarkable correlation was obtained between the evaluated interaction force data and the fouling behavior of the membranes with different surface energy. Membranes with low surface energy were fouled by hydrophobic, low surface tension foulants via "attractive" and subsequent "adsorptive" interaction mechanisms. Furthermore, such membranes have a higher fouling potential than membranes with high or ultralow surface energy.

Journal ArticleDOI
TL;DR: It is found that a gallium-based liquid metal droplet can quickly transform into a puddle on the CuGa2 surface through a spreading-wetting procedure, and the tested metallic bond wetting force at the interface is proportional to the average adsorption energy of the gallia-based LM adatom, and increases with the rising content of gallium.
Abstract: Interface interaction can strongly modify contact angle, adsorption energy, interfacial tension, and composition of the contact area. In particular, the interfaces between gallium-based liquid metal (LM) and its intermetallic layer present many mysterious and peculiar wetting phenomena, which have not been fully realized up to now. Here in this study, we found that a gallium-based liquid metal droplet can quickly transform into a puddle on the CuGa2 surface through a spreading–wetting procedure. The mechanism lying behind this phenomenon can be ascribed to the formation of an intermetallic CuGa2 on Cu plate surface, which provides a stable metallic bond to induce the wetting behavior. For a quantitative evaluation of the interface force, a metallic bond-enabled wetting model is established on the basis of the density functional theory. The first-principles density functional calculations are then performed to examine the work function, density of states, and adsorption energy. The predicted results show t...

Journal ArticleDOI
TL;DR: It is reported, through the first use of rotating optical coherence tomography, that a change in the flow pattern and speed occurs when evaporating binary liquid droplets are tilted, conclusively showing that gravitational effects dominate the flow.
Abstract: In the evaporation of microlitre liquid droplets, the accepted view is that surface tension dominates and the effect of gravity is negligible. We report, through the first use of rotating optical coherence tomography, that a change in the flow pattern and speed occurs when evaporating binary liquid droplets are tilted, conclusively showing that gravitational effects dominate the flow. We use gas chromatography to show that these flows are solutal in nature, and we establish a flow phase diagram demonstrating the conditions under which different flow mechanisms occur.

Journal ArticleDOI
TL;DR: In this paper, a robust numerical model was developed to simulate convective fluid flow and balancing of surface tension forces at the air-fluid interface to predict melt-pool free surface curvature and solidified clad dimensions.

Journal ArticleDOI
TL;DR: Visualizations of the flow field by particle image velocimetry and numerical simulations reveal that the timescale of water evaporation at the droplet rim is faster than that of the Marangoni flow, which originates from the surface tension difference between water and 1,2-hexanediol, eventually leading to segregation.
Abstract: Droplet evaporation of multicomponent droplets is essential for various physiochemical applications, e.g., in inkjet printing, spray cooling, and microfabrication. In this work, we observe and study the phase segregation of an evaporating sessile binary droplet, consisting of a miscible mixture of water and a surfactantlike liquid (1,2-hexanediol). The phase segregation (i.e., demixing) leads to a reduced water evaporation rate of the droplet, and eventually the evaporation process ceases due to shielding of the water by the nonvolatile 1,2-hexanediol. Visualizations of the flow field by particle image velocimetry and numerical simulations reveal that the timescale of water evaporation at the droplet rim is faster than that of the Marangoni flow, which originates from the surface tension difference between water and 1,2-hexanediol, eventually leading to segregation.

Journal ArticleDOI
TL;DR: In this article, two new sequences of Gemini di-quaternary ammonium salts were synthesized characterized by FTIR and 1HNMR spectroscopic techniques and evaluated as corrosion inhibitor for X-65 steel dissolution in deep oil wells formation water saturated with CO2.

Journal ArticleDOI
Haihu Liu1, Yan Ba1, Lei Wu, Zhen Li1, Guang Xi1, Yonghao Zhang 
TL;DR: In this article, the immiscible two-phase flow is solved by an improved lattice Boltzmann color-gradient model that incorporates a Marangoni stress resulting from non-uniform interfacial tension, while the convection-diffusion equation which describes the evolution of surfactant concentration in the entire fluid domain is solved using a finite difference method.
Abstract: Droplet dynamics in microfluidic applications is significantly influenced by surfactants. It remains a research challenge to model and simulate droplet behavior including deformation, breakup and coalescence, especially in the confined microfluidic environment. Here we propose a hybrid method to simulate interfacial flows with insoluble surfactants. The immiscible two-phase flow is solved by an improved lattice Boltzmann color-gradient model that incorporates a Marangoni stress resulting from non-uniform interfacial tension, while the convection-diffusion equation which describes the evolution of surfactant concentration in the entire fluid domain is solved by a finite difference method. The lattice Boltzmann and finite difference simulations are coupled through an equation of state, which describes how surfactant concentration influences interfacial tension. Our method is first validated for the surfactant-laden droplet deformation in a three- dimensional (3D) extensional flow and a 2D shear flow, and then applied to investigate the effect of surfactants on droplet dynamics in a 3D shear flow. Numerical results show that, at low capillary numbers, surfactants increase droplet deformation, due to reduced interfacial tension by the average surfactant concentration, and non-uniform effects from non-uniform capillary pressure and Marangoni stresses. The role of surfactants on critical capillary number (Cacr) of droplet breakup is investigated for various confinements (defined as the ratio of droplet diameter to wall separation) and Reynolds numbers. For clean droplets, Cacr first decreases and then increases with confinement, and the minimum value of Cacr is reached at the confinement of 0.5; for surfactant-laden droplets, Cacr exhibits the same variation in trend for the confinements lower than 0.7, but for higher confinements, Cacr is almost a constant. The presence of surfactants decreases Cacr for each confinement, and the decrease is also attributed to the reduction in average interfacial tension and non-uniform effects, which are found to prevent droplet breakup at low confinements but promote breakup at high confinements. In either clean or surfactant-laden cases, Cacr first keeps almost unchanged and then decreases with increasing Reynolds number, and a higher confinement or Reynolds number favors ternary breakup. Finally, we study the collision of two equal-sized droplets in a shear flow in both surfactant-free and surfactant-contaminated systems with the same effective capillary numbers. It is identified that the non-uniform effects in near-contact interfacial region immobilize the interfaces when two droplets are approaching each other and thus inhibit their coalescence.

Journal ArticleDOI
TL;DR: A thermodynamically consistent free energy model for fluid flows comprised of one gas and two liquid components is presented and implemented using the entropic lattice Boltzmann scheme, and it is demonstrated that it can capture the bouncing, adhesive, and insertive regimes for the binary collisions between immiscible droplets suspended in air.
Abstract: A thermodynamically consistent free energy model for fluid flows comprised of one gas and two liquid components is presented and implemented using the entropic lattice Boltzmann scheme. The model allows a high density ratio, up to the order of O(10^{3}), between the liquid and gas phases, and a broad range of surface tension ratios, covering partial wetting states where Neumann triangles are formed, and full wetting states where complete encapsulation of one of the fluid components is observed. We further demonstrate that we can capture the bouncing, adhesive, and insertive regimes for the binary collisions between immiscible droplets suspended in air. Our approach opens up a vast range of multiphase flow applications involving one gas and several liquid components.

Journal ArticleDOI
TL;DR: In this paper, drop formation in a microfluidic flow-focusing device (cross-junction) was studied in absence and presence of one of two ionic surfactants.

Journal ArticleDOI
TL;DR: A generalization of an all-Mach formulation for multiphase flows accounting for surface tension and viscous forces is presented, with results showing the robustness of the method to simulate the collapse of air bubbles in liquids in problems where bubbles generate a high velocity liquid jet.

Journal ArticleDOI
TL;DR: In this article, the fundamental equations for Form II of Mindlin's second strain gradient elasticity theory for isotropic materials are derived and a corresponding simplified formulation is then proposed, with six and two higher-order material parameters for the strain and kinetic energy, respectively.
Abstract: The fundamental equations for Form II of Mindlin's second strain gradient elasticity theory for isotropic materials are first derived. A corresponding simplified formulation is then proposed, with six and two higher-order material parameters for the strain and kinetic energy, respectively. This simplified model is still capable of accounting for free surface effects and surface tension arising in second strain gradient continua. Within the simplified model, at first, surface tension effects appearing in nano-scale solids near free boundaries are analyzed. Next, a thin strip under tension and shear is considered and closed-form solutions are provided for analyzing the free surface effects. Expressions for effective Poisson's ratio and effective shear modulus are proposed and found to be size-dependent. Most importantly, for each model problem a stability analysis is accomplished disallowing non-physical solutions (befallen but not exclusively disputed in a recent Form I article). Finally, a triangular macro-scale lattice structure of trusses is shown, as a mechanical metamaterial, to behave as a second strain gradient continuum. In particular, it is shown that initial stresses prescribed on boundaries can be associated to one of the higher-order material parameters, modulus of cohesion, giving rise to surface tension. For completeness, a numerical free vibration eigenvalue analysis is accomplished for both a fine-scale lattice model and the corresponding second-order continuum via standard and isogeometric finite element simulations , respectively, completing the calibration procedure for the higher-order material parameters. The eigenvalue analysis confirms the necessity of the second velocity gradient terms in the kinetic energy density .

Journal ArticleDOI
TL;DR: In this article, the effects of temperature and solid volume fraction (0.1% to 1.0%) on the thermophysical properties of water-based nanofluids have been investigated.

Journal ArticleDOI
TL;DR: The TIP4P2005 (four-point) water model is shown to be the most accurate water model for predicting the interfacial properties of water and the SPC/E watermodel is the best three-point parameterisation of water for this purpose.
Abstract: In this study, classical molecular dynamic simulations have been used to examine the molecular properties of the water-alkane interface at various NaCl salt concentrations (up to 3.0 mol/kg). A variety of different force field combinations have been compared against experimental surface/interfacial tension values for the water-vapour, decane-vapour and water-decane interfaces. Six different force fields for water (SPC, SPC/E, TIP3P, TIP3Pcharmm, TIP4P & TIP4P2005), and three further force fields for alkane (TraPPE-UA, CGenFF & OPLS) have been compared to experimental data. CGenFF, OPLS-AA and TraPPE-UA all accurately reproduce the interfacial properties of decane. The TIP4P2005 (four-point) water model is shown to be the most accurate water model for predicting the interfacial properties of water. The SPC/E water model is the best three-point parameterisation of water for this purpose. The CGenFF and TraPPE parameterisations of oil accurately reproduce the interfacial tension with water using either the TIP4P2005 or SPC/E water model. The salinity dependence on surface/interfacial tension is accurately captured using the Smith & Dang parameterisation of NaCl. We observe that the Smith & Dang model slightly overestimates the surface/interfacial tensions at higher salinities (>1.5 mol/kg). This is ascribed to an overestimation of the ion exclusion at the interface.

Journal ArticleDOI
10 Apr 2018-Langmuir
TL;DR: A novel, practical model is proposed, which can reasonably predict the maximum deformation of low Reynolds number impact of droplets onto hydrophobic or superhydrophobic spherical solid surfaces.
Abstract: The spreading and rebound patterns of low-viscous droplets upon impacting spherical solid surfaces are investigated numerically. The studied cases consider a droplet impinging onto hydrophobic and superhydrophobic surfaces with various parameters varied throughout the study, and their effects on the postimpingement behavior are discussed. These parameters include impact Weber number (through varying the surface tension and impingement velocity), the size ratio of the droplet to the solid surface, and the surface contact angle. According to the findings, the maximum spreading diameter increases with the impact velocity, with an increase of the sphere diameter, with a lower surface wettability, and with a lower surface tension. Typical outcomes of the impact include (1) complete rebound, (2) splash, and (3) a final deposition stage after a series of spreading and recoiling phases. Finally, a novel, practical model is proposed, which can reasonably predict the maximum deformation of low Reynolds number impact of droplets onto hydrophobic or superhydrophobic spherical solid surfaces.

Journal ArticleDOI
TL;DR: In this article, a 3D finite element modeling of the selective laser melting process (SLM) at the track scale is used to assess the impact of two phenomena on the shape of the elementary track resulting from SLM processing.
Abstract: The present study is based on a formerly developed 3D finite element modelling of the selective laser melting process (SLM) at the track scale. This numerical model is used to assess the impact of two phenomena on the shape of the elementary track resulting from SLM processing: laser interaction on one hand, and Marangoni effect on the other hand. As regards laser interaction, it is modelled by a Beer-Lambert type heat source, in which lateral scattering and material absorption are considered through two characteristic parameters. The impact of these parameters is shown in terms of width and depth of melted zone. The Marangoni effect caused by tangential gradients of surface tension is modelled to simulate the fluid dynamics in the melt pool. The resulting convection flow is demonstrated with surface tension values either increasing or decreasing with temperature. The influence of energy distribution, surface tension effects, as well as laser scanning speed on temperature distribution and melt pool geometry is investigated. The stability and regularity of the solidified track are a direct output of the simulations, and their variations with material and process conditions are discussed.