Water a comprehensive treatise: volume 4: aqueous solutions of amphiphiles and macromolecules

F Franks - 2013 - books.google.com
This volume of" Water-A Comprehensive Treatise" is devoted to aqueous solutions of
macromolecules and aqueous systems of small molecules which exhibit reversible …

[图书][B] Computer simulation using particles

RW Hockney, JW Eastwood - 2021 - taylorfrancis.com
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 …

[图书][B] Diffusion in liquids: a theoretical and experimental study

HJV Tyrrell, KR Harris - 2013 - books.google.com
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 …

Interionic potentials in alkali halides and their use in simulations of the molten salts

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 …

Ionic conduction in the solid state

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 …

Molecular dynamics and Monte Carlo calculations in statistical mechanics.

WW Wood, JJ Erpenbeck - Annu. Rev. Phys. Chem.;(United States), 1976 - osti.gov
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 …

Computation of methodology-independent single-ion solvation properties from molecular simulations. IV. Optimized Lennard-Jones interaction parameter sets for the …

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 …

A brief guide to the structure of high-temperature molten salts and key aspects making them different from their low-temperature relatives, the ionic liquids

S Sharma, AS Ivanov, CJ Margulis - The Journal of Physical …, 2021 - ACS Publications
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 …

[图书][B] Advances in chemical physics

I Prigogine, SA Rice - 2009 - books.google.com
Coverage includes five chapters entitled Criticality of Ionic Fluids; Mode Coupling Theory
Approach to Liquid State Dynamics; Anomalous Stochastic Processes in the Fractional …

Accurate computation of shear viscosity from equilibrium molecular dynamics simulations

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 …