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Effects of surface hydration on the electron injection rate from graphene to anatase and rutile TiO 2 surfaces
The effect of hydration of anatase (0 0 1), and rutile (0 0 1), (1 0 1) and (1 1 0) surfaces of TiO 2 on the rate of electron capture from an adsorbed graphene sheet is elucidated by means of computation at a level of tight-binding density functional theory. Initially, the clean surfaces are allowed to interact with bulk water. Following an equilibration period, the first solvation shell is exposed to vacuum at 300 K for a sufficiently long period of time to allow any weakly bound water molecules to evaporate or be displaced from the surface. The resultant hydroxylated and originally clean surfaces are used for studying the interaction with a graphene sheet. Comparison of the calculated surface-graphene interaction energies and electron transfer probabilities of a cold electron to clean and hydroxylated surfaces shows that the water-sourced OH layer of these surfaces acts as an insulator in interfacial charge transport of the cold electron.
Fatigue behavior and modeling for additive manufactured 304L stainless steel: The effect of surface roughness
The fatigue strength of additively manufactured metallic parts in their as-built surface condition is mainly dominated by the surface roughness. Post-processing is often inevitable to reduce surface roughness effects even though post-processing diminishes the main advantage of additive manufacturing, which is net-shaped direct-to-service production. This work investigates the underlying mechanisms responsible for fatigue failure of additively manufactured 304L stainless steel parts in as-built and machined/polished surface conditions. Both strain- and force-controlled, fully reversed fatigue tests were conducted to gain a comprehensive understanding of surface roughness effects on fatigue behavior. The sensitivity to surface roughness is shown to be dependent on the control mode, with stress-based fatigue tests showing greater sensitivity than strain-based fatigue tests. Moreover, the fatigue life estimation for as-built specimens was performed based on surface roughness parameters as well as the fatigue properties of the specimens in machined/polished surface condition of the material without using any fatigue data of specimens in as-built surface condition. Accordingly, the effect of surface roughness on the fatigue behavior could be estimated reasonably well in both strain-life and stress-life approaches.
Diffuse spectral reflectance of metal surfaces
Effect of surface finish on diffuse spectral directional reflectance of metals
Surface Tension Effects on the Reactivity of Metal Nanoparticles
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Including Finite Surface Span Effects in Empirical Jet-Surface Interaction Noise Models
The effect of finite span on the jet-surface interaction noise source and the jet mixing noise shielding and reflection effects is considered using recently acquired experimental data. First, the experimental setup and resulting data are presented with particular attention to the role of surface span on far-field noise. These effects are then included in existing empirical models that have previously assumed that all surfaces are semi-infinite. This extended abstract briefly describes the experimental setup and data leaving the empirical modeling aspects for the final paper.
Including Finite Surface Span Effects in Empirical Jet-Surface Interaction Noise Models
The effect of finite span on the jet-surface interaction noise source and the jet mixing noise shielding and reflection effects is considered using recently acquired experimental data. First, the experimental setup and resulting data are presented with particular attention to the role of surface span on far-field noise. These effects are then included in existing empirical models that have previously assumed that all surfaces are semi-infinite. This extended abstract briefly describes the experimental setup and data leaving the empirical modeling aspects for the final paper.
Including Finite Surface Span Effects in Empirical Jet-Surface Interaction Noise Models
The effect of finite span on the jet-surface interaction noise source and the jet mixing noise shielding and reflection effects is considered using recently acquired experimental data. First, the experimental setup and resulting data are presented with particular attention to the role of surface span on far-field noise. These effects are then included in existing empirical models that have previously assumed that all surfaces are semi-infinite. This extended abstract briefly describes the experimental setup and data leaving the empirical modeling aspects for the final paper.
Surface roughness effects on radiant transfer between surfaces
Radiative heat transfer between opaque interacting surfaces, investigating surface roughness effects
Preliminary analytical results using surface current integration for predicting effects of surface pillows on RF performance
An overview of the fast integral RF evaluation (FIRE) program is presented. This program uses surface current integration to evaluate RF performance of antenna systems. It requires modeling of surfaces in X, Y, Z coordinates along equally spaced X and Y grids with Z in the focal directon. The far field contribution of each surface point includes the effects of the Z-component of surface current which is not included in the aperture integration technique. Because of this, surface current integration is the most effective and inclusive technique for predicting RF performance on non-ideal reflectors. Results obtained from use of the FIRE program and an aperture integration program to predict RF performance of a LSS antenna concept are presented.
Effect of Surface Preparation and Gas Flow on Nitrogen Atom Surface Recombination
The effects of surface preparation and gas flow on the recombination of nitrogen atoms at copper and platinum surfaces were determined. Atoms were generated by an electrodeless 2450-megacycle-per-second discharge, and their concentration was measured by gas-phase titration with nitric oxide. Test surfaces were either vacuum-evaporated films or spheres machined from bulk metal and cemented around small glass-bead thermistors. Heat released by recombination was measured as the difference in electrical energy required to maintain a given thermistor temperature with and without a catalytic surface exposed. Recombination coefficients measured at flow velocities of 1120, 1790, 2250, and 3460 centimeters per second and at pressures of 0.42 and 0.59 millimeter of mercury showed that flow conditions had no effect. The results were also independent of atom concentration. A rough indication of the temperature dependence was obtained; it was greater for copper than for platinum. Platinum films deposited on platinum or on glass had the same activity - about 3 percent of the atoms impinging recombined. With copper, however, the glass substrate greatly reduced the percent of atoms recombining over that of a bulk copper substrate where 4 percent of the impinging atoms recombined. This effect could be overcome by depositing a second film on top of the first. Bulk metal samples were subjected to various surface treatments including polishing, degreasing with a chlorinated hydrocarbon, washing with nitric acid, and rinsing with water. Polished, degreased platinum had low activity compared to an evaporated film, but nitric acid treatment made it equivalent. Polished, degreased copper was only slightly less active than a copper film; nitric acid etching decreased the activity still further, probably by preferentially exposing facets of low catalytic efficiency.
Effects of surface conditions on nucleate pool boiling of sodium.
Commercial grade sodium boiling from horizontal disk at various pressures and temperatures attaining high heat fluxes, noting surface finish effects
Effects of surface conditions on nucleate pool boiling of sodium.
Commercial grade sodium boiling from horizontal disk at various pressures and temperatures attaining high heat fluxes, noting surface finish effects
Surface Corrugation Effects on the Water–Graphene Interfacial and Confinement Behavior
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A study of the electrical properties of p-n junctions formed by ion-implantation into gallium arsenide
In the process of ion implantation, ion beams bombard the surface and create undesirable surface effects. The surface effects were investigated, and surface leakage currents were shown to be reduced by surface treatment. I-V characteristics and C-V measurements were obtained for the Zn-GaAs and Zn-(In,Ga)As junction is considered as a p-i-n heterojunction, without generation-recombination current. The Zn-GaAs junction is considered as a p-n homojunction with appreciable generation-recombination currents.
Promotional effect of surface hydroxyls on electrochemical reduction of CO2 over SnOx/Sn electrode
Tin oxide (SnOx) formation on tin-based electrode surfaces during CO2 electrochemical reduction can have a significant impact on the activity and selectivity of the reaction. In the present study, density functional theory (DFT) calculations have been performed to understand the role of SnOx in CO2 reduction using a SnO monolayer on the Sn(112) surface as a model for SnOx. Water molecules have been treated explicitly and considered actively participating in the reaction. The results showed that H2O dissociates on the perfect SnO monolayer into two hydroxyl groups symmetrically on the surface. CO2 energetically prefers to react with the hydroxyl, forming a bicarbonate (HCO3(t)*) intermediate, which can then be reduced to either formate (HCOO*) by hydrogenating the carbon atom or carboxyl (COOH*) by protonating the oxygen atom. Both steps involve a simultaneous C-O bond breaking. Further reduction of HCOO* species leads to the formation of formic acid in the acidic solution at pH < 4, while the COOH* will decompose to CO and H2O via protonation. Whereas the oxygen vacancy (VO) in the monolayer maybe formed by the reduction of the monolayer, it can be recovered by H2O dissociation, resulting in two embedded hydroxyl groups. However, the hydroxylated surface with two symmetric hydroxyls is energetically more favorable for CO2 reduction than the hydroxylated VO surface with two embedded hydroxyls. The reduction potential for the former has a limiting-potential of -0.20 V (RHE), lower than that for the latter (-0.74 V (RHE)). Compared to the pure Sn electrode, the formation of SnOx monolayer on the electrode under the operating conditions promotes CO2 reduction more effectively by forming surface hydroxyls, thereby, providing a new channel via COOH* to the CO formation, although formic acid is still the major reduction product. The work was supported in part by National Natural Sciences Foundation of China (Grant #21373148 and #21206117). The High Performance Computing Center of Tianjin University is acknowledged for providing services to the computing cluster. CC acknowledges the support of 24 China Scholarship Council (CSC). QG acknowledges the support of NSF-CBET program (Award no. CBET-1438440). DM was supported by the US Department of Energy, Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences & Biosciences. The computations were performed in part using the Molecular Science Computing Facility in the William R. Wiley Environmental Molecular Sciences Laboratory (EMSL), which is a U.S. Department of Energy national scientific user facility located at Pacific Northwest National Laboratory (PNNL) in Richland, Washington.
Surface roughness effects on equilibrium temperature of interacting surfaces
Radiatively interacting adjoint plates in presence of collimated solar flux, considering surface roughness effects on equilibrium temperature distribution