Polymers at interfaces and the interactions in colloidal dispersions

A Vrij - Pure and Applied Chemistry, 1976 - degruyter.com
Solutions of different polymers in the same solvent are incompatible as a rule and show
phase separation when they are mixed. H incompatibility is also to be observed in systems …

DynamO: a free \calO (N) general event‐driven molecular dynamics simulator

MN Bannerman, R Sargant… - Journal of computational …, 2011 - Wiley Online Library
Molecular dynamics algorithms for systems of particles interacting through discrete or “hard”
potentials are fundamentally different to the methods for continuous or “soft” potential …

Pseudo hard-sphere potential for use in continuous molecular-dynamics simulation of spherical and chain molecules

J Jover, AJ Haslam, A Galindo, G Jackson… - The Journal of chemical …, 2012 - pubs.aip.org
We present a continuous pseudo-hard-sphere potential based on a cut-and-shifted Mie
(generalized Lennard-Jones) potential with exponents (50, 49). Using this potential one can …

Modeling the structure and thermodynamics of multicomponent and polydisperse hard-sphere dispersions with continuous potentials

J Martínez-Rivera, A Villada-Balbuena… - The Journal of …, 2023 - pubs.aip.org
A model system of identical particles interacting via a hard-sphere potential is essential in
condensed matter physics; it helps to understand in and out of equilibrium phenomena in …

A comprehensive study of the thermal conductivity of the hard sphere fluid and solid by molecular dynamics simulation

S Pieprzyk, AC Brańka, DM Heyes… - Physical Chemistry …, 2020 - pubs.rsc.org
This work reports a new set of hard sphere (HS) thermal conductivity coefficient, λ, data
obtained by Molecular Dynamics (MD) computer simulation, over a density range covering …

[HTML][HTML] Numerical solution of a multi-class model for batch settling in water resource recovery facilities

R Bürger, S Diehl, MC Martí, P Mulet, I Nopens… - Applied Mathematical …, 2017 - Elsevier
Abstract In Torfs et al.(2017) a new unified framework to model settling tanks in water
resource recovery facilities was proposed providing a set of partial differential equations …

Molecular simulation of homogeneous crystal nucleation of AB2 solid phase from a binary hard sphere mixture

PK Bommineni, SN Punnathanam - The Journal of Chemical Physics, 2017 - pubs.aip.org
Co-crystal formation from fluid-mixtures is quite common in a large number of systems. The
simplest systems that show co-crystal (also called substitutionally ordered solids) formation …

Optical Methods

AP Fröba, S Will, Y Nagasaka, J Winkelmann… - 2014 - books.rsc.org
Surface light scattering (SLS) probes, as the name indicates, the dynamics of thermal
fluctuations on the surface of a liquid or, in a more general formulation, at phase boundaries …

Chemical potential of a test hard sphere of variable size in hard-sphere fluid mixtures

DM Heyes, A Santos - The Journal of chemical physics, 2018 - pubs.aip.org
A detailed comparison between the Boublík–Mansoori–Carnahan–Starling–Leland
(BMCSL) equation of state of hard-sphere mixtures is made with Molecular Dynamics (MD) …

Long-lived non-equilibrium interstitial solid solutions in binary mixtures

I Ríos de Anda, F Turci, RP Sear… - The Journal of Chemical …, 2017 - pubs.aip.org
We perform particle resolved experimental studies on the heterogeneous crystallisation
process of two component mixtures of hard spheres. The components have a size ratio of …