Bottom-up coarse-graining: Principles and perspectives
Large-scale computational molecular models provide scientists a means to investigate the
effect of microscopic details on emergent mesoscopic behavior. Elucidating the relationship …
effect of microscopic details on emergent mesoscopic behavior. Elucidating the relationship …
Theory of structural glasses and supercooled liquids
We review the random first-order transition theory of the glass transition, emphasizing the
experimental tests of the theory. Many distinct phenomena are quantitatively predicted or …
experimental tests of the theory. Many distinct phenomena are quantitatively predicted or …
Optimized cluster expansions for classical fluids. II. Theory of molecular liquids
D Chandler, HC Andersen - The Journal of Chemical Physics, 1972 - pubs.aip.org
The optimized cluster expansion methods developed in the first article of this series (I) are
generalized to apply to molecular fluids. These methods make use of summations of ring …
generalized to apply to molecular fluids. These methods make use of summations of ring …
Theory of the hydrophobic effect
A microscopic theory is developed which can describe many of the structural and
thermodynamic properties of infinitely dilute solutions of apolar solutes in liquid water. The …
thermodynamic properties of infinitely dilute solutions of apolar solutes in liquid water. The …
Colloidal hard spheres: Triumphs, challenges, and mysteries
The simplicity of hard spheres as a model system is deceptive. Although the particles
interact solely through volume exclusion, that nevertheless suffices for a wealth of static and …
interact solely through volume exclusion, that nevertheless suffices for a wealth of static and …
Perspective: Excess-entropy scaling
JC Dyre - The Journal of chemical physics, 2018 - pubs.aip.org
This article gives an overview of excess-entropy scaling, the 1977 discovery by Rosenfeld
that entropy determines properties of liquids like viscosity, diffusion constant, and heat …
that entropy determines properties of liquids like viscosity, diffusion constant, and heat …
Van der Waals picture of liquids, solids, and phase transformations
The van der Waals picture focuses on the differing roles of the strong short-ranged repulsive
intermolecular forces and the longer ranged attractions in determining the structure and …
intermolecular forces and the longer ranged attractions in determining the structure and …
Dynamics on the way to forming glass: Bubbles in space-time
We review a theoretical perspective of the dynamics of glass-forming liquids and the glass
transition, a perspective developed during this past decade based on the structure of …
transition, a perspective developed during this past decade based on the structure of …
Extended corresponding-states behavior for particles with variable range attractions
We propose an extension of the law of corresponding states that can be applied to systems—
such as colloidal suspensions—that have widely different ranges of attractive interactions …
such as colloidal suspensions—that have widely different ranges of attractive interactions …
Perturbation theory of the thermodynamic properties of simple liquids
This note supplements our recent publication'(I) on the role of repulsive forces in
determining the structure of simple liquids. The ideas presented in I are a basis for a rapidly …
determining the structure of simple liquids. The ideas presented in I are a basis for a rapidly …