Employing recent advances in response theory and nonequilibrium ensemble reweighting, we study the dynamic and static correlations that give rise to an electric field-dependent ionic conductivity in electrolyte solutions. We consider solutions modeled with both implicit and explicit solvents, with different dielectric properties, and at multiple concentrations. Implicit solvent models at low concentrations and small dielectric constants exhibit strongly field-dependent conductivities.
View Article and Find Full Text PDFWe derive a relationship for the electric field dependent ionic conductivity in terms of fluctuations of time integrated microscopic variables. We demonstrate this formalism with molecular dynamics simulations of solutions of differing ionic strength with implicit solvent conditions and molten salts. These calculations are aided by a novel nonequilibrium statistical reweighting scheme that allows for the conductivity to be computed as a continuous function of the applied field.
View Article and Find Full Text PDFThis paper aims to identify the atmospheric boundary layer turbulence structure and its effect on severe foggy haze events frequently occurring in Northern China. We use data collected from a ground eddy covariance system, meteorology tower, and a PM collector in Baoding, China during December 2016. The data shows that 73.
View Article and Find Full Text PDFIn this study, we examine and present the relationship between drag coefficient and wind speed. We used an observational dataset that consists of 806 estimates of the mean flow and fluxes from aircraft eddy-covariance measurements over the tropical Eastern Pacific. To estimate the saturated wind speed threshold, we regressed the drag coefficients for wind speed scope from 10 ms to 28 ms.
View Article and Find Full Text PDFNonlinear response occurs naturally when a strong perturbation takes a system far from equilibrium. Despite its omnipresence in nanoscale systems, it is difficult to predict in a general and efficient way. Here, we introduce a way to compute arbitrarily high order transport coefficients of stochastic systems, using the framework of large deviation theory.
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