The orientational statistics of water molecules at the vicinity of the water/CCl4 liquid–liquid
interface is analyzed at different levels of statistics on the basis of a Monte Carlo computer …

We analyze and compare the structure of the electrochemical double layer obtained from
molecular dynamics simulations of concentrated aqueous NaCl and CsF solutions near a …

The application of molecular dynamics (MD) simulations of the interface between an
aqueous electrolyte solution and a solid surface to the investigation of structure, dynamics …

The modeling and nature of the physisorption of water at the metal Hg-water interface is
explored in this paper. We have evaluated potential models that fit into three general classes …

In this work we present the results of molecular dynamics simulations of the electrical double
layer (edl) of a metal∣ electrolyte solution (Hg∣ 1.0 M KCl) interface at three different …

Theoretical results are given for aqueous electrolyte solutions in contact with uncharged
metallic surfaces. The metal is modeled as a jellium slab and is treated using local density …

Adsorption of the halide ions X (X= Cl−, Br−, I−) at a cadmium monocrystalline face (0001)
from aqueous solutions has been studied by the impedance spectroscopy. Analysis of the …

From extensive ab initio calculations on the interactions between mercury clusters and alkali
and halide ions we have derived analytical pair-potential functions for the interaction …

During the past few decades, significant changes have been taking place in the area of
electrochemistry. The traditional kinetic approach for elucidating electrochemical …

We present previously unpublished results and summarize recent computer simulation
studies of the interfaces between water or aqueous solutions and liquid or solid mercury …