Vibrational spectroscopy and dynamics of water

F Perakis, L De Marco, A Shalit, F Tang… - Chemical …, 2016 - ACS Publications
We present an overview of recent static and time-resolved vibrational spectroscopic studies
of liquid water from ambient conditions to the supercooled state, as well as of crystalline 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 …

Hidden scale invariance in condensed matter

JC Dyre - The Journal of Physical Chemistry B, 2014 - ACS Publications
Recent developments show that many liquids and solids have an approximate “hidden”
scale invariance that implies the existence of lines in the thermodynamic phase diagram, so …

Modified entropy scaling of the transport properties of the Lennard-Jones fluid

IH Bell, R Messerly, M Thol, L Costigliola… - The Journal of …, 2019 - ACS Publications
Rosenfeld proposed two different scaling approaches to model the transport properties of
fluids, separated by 22 years, one valid in the dilute gas, and another in the liquid phase. In …

Excess-entropy scaling in supercooled binary mixtures

IH Bell, JC Dyre, TS Ingebrigtsen - Nature communications, 2020 - nature.com
Transport coefficients, such as viscosity or diffusion coefficient, show significant dependence
on density or temperature near the glass transition. Although several theories have been …

Entropy scaling of viscosity—III: Application to refrigerants and their mixtures

X Yang, X **ao, EF May, IH Bell - Journal of Chemical & …, 2021 - ACS Publications
The residual entropy scaling of viscosity was applied to pure refrigerants, including natural
refrigerants, hydrofluoroolefins, hydrochlorofluoroolefins, perfluorocarbons …

Pure substance and mixture viscosities based on entropy scaling and an analytic equation of state

O Lötgering-Lin, M Fischer, M Hopp… - Industrial & Engineering …, 2018 - ACS Publications
This study proposes a simple model for viscosities, based on entropy scaling, for real
substances and mixtures. The residual entropy is calculated with the perturbed chain polar …

What is a simple liquid?

TS Ingebrigtsen, TB Schrøder, JC Dyre - Physical Review X, 2012 - APS
This paper is an attempt to identify the real essence of simplicity of liquids in John Locke's
understanding of the term. Simple liquids are traditionally defined as many-body systems of …

Role of Anisotropy in Understanding the Molecular Grounds for Density Scaling in Dynamics of Glass-Forming Liquids

A Grzybowski, K Koperwas… - Reports on Progress in …, 2024 - iopscience.iop.org
Molecular Dynamics MD simulations of glass-forming liquids play a pivotal role in
uncovering the molecular nature of the liquid vitrification process. In particular, much focus …

Probing the link between residual entropy and viscosity of molecular fluids and model potentials

IH Bell - Proceedings of the National Academy of Sciences, 2019 - National Acad Sciences
This work investigates the link between residual entropy and viscosity based on wide-
ranging, highly accurate experimental and simulation data. This link was originally …