Temperature and curvature-dependent thermal interface conductance between nanoscale-gold and water from molecular simulation

Plasmonic gold nanoparticles (AuNPs) can convert laser irradiation into thermal energy and act as nano heaters in avariety of applications. Although the AuNP-water interface is an essential part of the plasmonic heating process,there is a lack of mechanistic understanding of how interface curvature and the heating itself impact interfacial heattransfer. Here, we report atomistic molecular dynamics simulations that investigate heat transfer through nanoscalegold-water interfaces. We confirmed that interfacial heat transfer is an important part of AuNP heat dissipation inAuNPs with diameter less than 100 nm, particularly for small particles with diameter≤10 nm. To account forvariations in the gold-water interaction strength reported in the literature, and to implicitly account for differentsurface functionalizations, we modeled a moderate and a poor AuNP-water wetting scenario. We found that thethermal interface conductance increases linearly with interface curvature regardless of the gold wettability, while itincreases non-linearly, or remains constant, with the applied heat flux under different wetting conditions. Our analysissuggests the curvature dependence of the interface conductance is due to the changes in interfacial water adsorption,while the temperature dependence is caused by heat-induced shifts in the distribution of water vibrational states.Our study advances the current understanding of interface thermal conductance for a broad range of applications.

Influence of geometric attributes on friction coefficient in sheet metal stamping

This paper presents a test device to explore the influence of geometric attributes of the contact surface on a friction coefficient along with sliding speed and contact pressure. Friction tests were conducted on a third-generation high-strength steel QP980. The friction coefficients for different surface curvatures, contact pressures, and sliding speeds were calculated, and the influences of these factors were analyzed. The formula for calculating the friction coefficients between curved contact surfaces was derived. The relationship between bending-induced surface roughness increase and friction coefficient was established. An enhanced friction coefficient model with pressure, velocity, and curvature dependence was proposed. The enhanced friction model was applied to simulate the stamping of an automotive part, and a better correlation was achieved.

Assessment of Extrapolation Relations of Displacement Speed for Detailed Chemistry Direct Numerical Simulation Database of Statistically Planar Turbulent Premixed Flames

A three-dimensional Direct Numerical Simulation (DNS) database of statistically planar $$H_{2} -$$ H 2 - air turbulent premixed flames with an equivalence ratio of 0.7 spanning a large range of Karlovitz number has been utilised to assess the performances of the extrapolation relations, which approximate the stretch rate and curvature dependences of density-weighted displacement speed $$S_{d}^{*}$$ S d ∗ . It has been found that the correlation between $$S_{d}^{*}$$ S d ∗ and curvature remains negative and a significantly non-linear interrelation between $$S_{d}^{*}$$ S d ∗ and stretch rate has been observed for all cases considered here. Thus, an extrapolation relation, which assumes a linear stretch rate dependence of density-weighted displacement speed has been found to be inadequate. However, an alternative extrapolation relation, which assumes a linear curvature dependence of $$S_{d}^{*}$$ S d ∗ but allows for a non-linear stretch rate dependence of $$S_{d}^{*}$$ S d ∗ , has been found to be more successful in capturing local behaviour of the density-weighted displacement speed. The extrapolation relations, which express $$S_{d}^{*}$$ S d ∗ as non-linear functions of either curvature or stretch rate, have been found to capture qualitatively the non-linear curvature and stretch rate dependences of $$S_{d}^{*}$$ S d ∗ more satisfactorily than the linear extrapolation relations. However, the improvement comes at the cost of additional tuning parameter. The Markstein lengths LM for all the extrapolation relations show dependence on the choice of reaction progress variable definition and for some extrapolation relations LM also varies with the value of reaction progress variable. The predictions of an extrapolation relation which involve solving a non-linear equation in terms of stretch rate have been found to be sensitive to the initial guess value, whereas a high order polynomial-based extrapolation relation may lead to overshoots and undershoots. Thus, a recently proposed extrapolation relation based on the analysis of simple chemistry DNS data, which explicitly accounts for the non-linear curvature dependence of the combined reaction and normal diffusion components of $$S_{d}^{*}$$ S d ∗ , has been shown to exhibit promising predictions of $$S_{d}^{*}$$ S d ∗ for all cases considered here.

Influence Of Geometric Attribute On Friction Coefficient In Sheet Metal Stamping

This paper presents a test device to explore the influence of geometric attribute of the contact surface on friction coefficient along with sliding speed and contact pressure. Friction tests were conducted on a third-generation high strength steel QP980. The friction coefficients for different surface curvatures, contact pressures and sliding speeds were calculated and the influences of these factors were analyzed. The formula for calculating the friction coefficients between curved contact surfaces was derived. The relationship between bending induced surface roughness increase and friction coefficient was established. An enhanced friction coefficient model with pressure, velocity and curvature dependence was proposed. The enhanced friction model was applied to simulate the stamping of an automotive part and a better correlation was achieved.

Quantum Gravity: A Fluctuating Point of View

In this contribution, we discuss the asymptotic safety scenario for quantum gravity with a functional renormalization group approach that disentangles dynamical metric fluctuations from the background metric. We review the state of the art in pure gravity and general gravity–matter systems. This includes the discussion of results on the existence and properties of the asymptotically safe ultraviolet fixed point, full ultraviolet-infrared trajectories with classical gravity in the infrared, and the curvature dependence of couplings also in gravity–matter systems. The results in gravity–matter systems concern the ultraviolet stability of the fixed point and the dominance of gravity fluctuations in minimally coupled gravity–matter systems. Furthermore, we discuss important physics properties such as locality of the theory, diffeomorphism invariance, background independence, unitarity, and access to observables, as well as open challenges.

Weyl anomaly induced Fermi condensation and holography

Recently it is found that, due to Weyl anomaly, a background scalar field induces a non-trivial Fermi condensation for theories with Yukawa couplings. For simplicity, the paper consider only scalar type Yukawa coupling and, in the BCFT case, only for a specific boundary condition. In these cases, the Weyl anomaly takes on a simple special form. In this paper, we generalize the results to more general situations. First, we obtain general expressions of Weyl anomaly due to a background scalar and pseudo scalar field in general 4d BCFTs. Then, we derive the general form of Fermi condensation from the Weyl anomaly. It is remarkable that, in general, Fermi condensation is non-zero even if there was not a non-vanishing scalar field background. Finally, we verify our results with free BCFT with Yukawa coupling to scalar and pseudo-scalar background potential with general chiral bag boundary condition and with holographic BCFT. In particular, we obtain the shape and curvature dependence of the Fermi condensate from the holographic one point function.

Surface charging parameters of charged particles in symmetrical electrolyte solutions

This research work is directed at development of accurate physics-based formulas for quantification of curvature-dependence of surface potential, surface charge density, and total surface charge for cylindrical and spherical charged particles immersed in a symmetrical electrolyte solution.

The correspondence between drag enhancement and vortical structures in turbulent Taylor–Couette flows with polymer additives: a study of curvature dependence

We report direct numerical simulation results that clearly elucidate the mechanism that leads to curvature dependence of drag enhancement (DE) in viscoelastic turbulent Taylor–Couette flow. Change in the angular momentum transport and its inherent link to transitions in vortical flow structures have been explored to depict the influence of the curvature of the flow geometry on DE. Specifically, it has been demonstrated that a transition in vortical structures with increasing radius ratio leads to weakening and elimination of the small-scale Görtler vortices and development and better organization (occupying the entire gap) of large-scale Taylor vortices as also evinced by the patterns of angular momentum current. The commensurate change in DE and its underlying mechanism are examined by contributions of convective flux and polymeric stress to the angular momentum current. The present finding paves the way for capturing highly localized elastic turbulence structures in direct numerical simulation by increasing geometry curvature in traditional turbulent curvilinear flows.