Computer simulation of systems has become an important tool in scientific research and engineering design, including the simulation of systems through the motion of their …
Diffusion in Liquids: A Theoretical and Experimental Study aims to discuss the principles, applications, and advances in the field of diffusion, thermal diffusion, and thermal conduction …
MJL Sangster, M Dixon - Advances in Physics, 1976 - Taylor & Francis
After an outline of work on rare-gas systems, which serves as a target for parallel work on alkali halides, and an initial brief survey of those parts of this parallel work for which results …
PP Kumar, S Yashonath - Journal of Chemical Sciences, 2006 - Springer
Solid state ionic conductors are important from an industrial viewpoint. A variety of such conductors have been found. In order to understand the reasons for high ionic conductivity …
Monte Carlo and molecular dynamics calculations on statistical mechanical systems is reviewed giving some of the more significant recent developments. It is noted that the term …
MM Reif, PH Hünenberger - The Journal of chemical physics, 2011 - pubs.aip.org
A companion article has been published: Computation of methodology-independent single- ion solvation properties from molecular simulations. III. Correction terms for the solvation free …
High-temperature molten salt research is undergoing somewhat of a renaissance these days due to the apparent advantage of these systems in areas related to clean and …
Coverage includes five chapters entitled Criticality of Ionic Fluids; Mode Coupling Theory Approach to Liquid State Dynamics; Anomalous Stochastic Processes in the Fractional …
D Nevins, FJ Spera - Molecular Simulation, 2007 - Taylor & Francis
The accuracy of the Green–Kubo formulation for computing shear viscosity from equilibrium molecular dynamics simulations depends on the quality of the potential and on how the …