Water: A tale of two liquids
Water is the most abundant liquid on earth and also the substance with the largest number
of anomalies in its properties. It is a prerequisite for life and as such a most important subject …
of anomalies in its properties. It is a prerequisite for life and as such a most important subject …
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 …
addendum: A universal scaling law for atomic diffusion in condensed matter
M Dzugutov - Nature, 2001 - nature.com
The human genome holds an extraordinary trove of information about human development,
physiology, medicine and evolution. Here we report the results of an international …
physiology, medicine and evolution. Here we report the results of an international …
Excess-entropy scaling in supercooled binary mixtures
Transport coefficients, such as viscosity or diffusion coefficient, show significant dependence
on density or temperature near the glass transition. Although several theories have been …
on density or temperature near the glass transition. Although several theories have been …
Understanding dynamics in coarse-grained models. I. Universal excess entropy scaling relationship
Coarse-grained (CG) models facilitate an efficient exploration of complex systems by
reducing the unnecessary degrees of freedom of the fine-grained (FG) system while …
reducing the unnecessary degrees of freedom of the fine-grained (FG) system while …
Atomistic computation of liquid diffusivity, solid-liquid interfacial free energy, and kinetic coefficient in Au and Ag
JJ Hoyt, M Asta - Physical Review B, 2002 - APS
Molecular-dynamics simulations using interatomic potentials of the embedded atom method
have been performed on pure Ag and Au to compute materials parameters which are …
have been performed on pure Ag and Au to compute materials parameters which are …
Entropy, diffusivity, and structural order in liquids with waterlike anomalies
R Sharma, SN Chakraborty… - The Journal of chemical …, 2006 - pubs.aip.org
The excess entropy, defined as the difference between the entropies of the liquid and the
ideal gas under identical density and temperature conditions, is studied as a function of …
ideal gas under identical density and temperature conditions, is studied as a function of …
Excess-entropy-based anomalies for a waterlike fluid
Many thermodynamic and dynamic properties of water display unusual behavior at low
enough temperatures. In a recent study, Yan et al [Phys. Rev. Lett. 95, 130604 (2005)] …
enough temperatures. In a recent study, Yan et al [Phys. Rev. Lett. 95, 130604 (2005)] …
Thermodynamics Predicts How Confinement Modifies the Dynamics<? format?> of the Equilibrium Hard-Sphere Fluid
We study how confining the equilibrium hard-sphere fluid to restrictive one-and two-
dimensional channels with smooth interacting walls modifies its structure, dynamics, and …
dimensional channels with smooth interacting walls modifies its structure, dynamics, and …
Liquid Aluminum: Atomic diffusion and viscosity from ab initio molecular dynamics
N Jakse, A Pasturel - Scientific reports, 2013 - nature.com
We present a study of dynamic properties of liquid aluminum using density-functional theory
within the local-density (LDA) and generalized gradient (GGA) approximations. We …
within the local-density (LDA) and generalized gradient (GGA) approximations. We …