[HTML][HTML] Universal properties of relaxation and diffusion in complex materials: Originating from fundamental physics with rich applications

KL Ngai - Progress in Materials Science, 2023 - Elsevier
Complex materials are composed of basic units which invariably interact with anharmonic
potentials. It is well known that the dynamics of systems with anharmonic interaction are …

Structure and dynamics of amorphous polymers: computer simulations compared to experiment and theory

W Paul, GD Smith - Reports on Progress in Physics, 2004 - iopscience.iop.org
This contribution considers recent developments in the computer modelling of amorphous
polymeric materials. Progress in our capabilities to build models for the computer simulation …

Influence of molecular weight on fast dynamics and fragility of polymers

Y Ding, VN Novikov, AP Sokolov, A Cailliaux… - …, 2004 - ACS Publications
The molecular weight dependence of the fast dynamics, sound velocity, and fragility has
been studied for polystyrene (PS) and polyisobutylene (PIB). These different physical …

Pressure and density dependence of the boson peak in polymers

L Hong, B Begen, A Kisliuk, C Alba-Simionesco… - Physical Review B …, 2008 - APS
The nature of the low-frequency vibrations, the so-called boson peak, in spectra of glass-
forming systems remains a subject of active discussions. It appears that densification of …

Cooperative dynamics in homopolymer melts: A comparison of theoretical predictions with neutron spin echo experiments

M Zamponi, A Wischnewski… - The Journal of …, 2008 - ACS Publications
We present a comparison between theoretical predictions of the generalized Langevin
equation for cooperative dynamics (CDGLE) and neutron spin echo data of dynamic …

Topological derivation of shape exponents for stretched exponential relaxation

JR Macdonald, JC Phillips - The Journal of chemical physics, 2005 - pubs.aip.org
In homogeneous (ideal) glasses, the important dimensionless stretched-exponential shape
parameter β is described by magic (not adjusted) simple fractions derived from fractal …

Interpreting the dynamics of nano‐confined glass‐formers and thin polymer films: Importance of starting from a viable theory for the bulk

KL Ngai - Journal of Polymer Science Part B: Polymer Physics, 2006 - Wiley Online Library
The changes of the dynamic properties of the nanoconfined materials vary greatly
depending on the nature of the interfaces, the chemical structure of the nanoconfined glass …

Inelastic neutron scattering for investigating the dynamics of confined glass-forming liquids

B Frick, C Alba-Simionesco, G Dosseh… - Journal of non …, 2005 - Elsevier
Inelastic neutron scattering was employed over recent years to investigate the influence of
spatial confinement on the dynamics of glass-forming systems. We review the common …

Theoretical reconstruction of realistic dynamics of highly coarse-grained cis-1, 4-polybutadiene melts

IY Lyubimov, MG Guenza - The Journal of Chemical Physics, 2013 - pubs.aip.org
The theory to reconstruct the atomistic-level chain diffusion from the accelerated dynamics
that is measured in mesoscale simulations of the coarse-grained system, is applied here to …

Atomistic molecular dynamics simulation of the temperature and pressure dependences of local and terminal relaxations in cis-1, 4-polybutadiene

G Tsolou, VA Harmandaris… - The Journal of chemical …, 2006 - pubs.aip.org
The dynamics of cis-1, 4-polybutadiene (cis-1, 4-PB) over a wide range of temperature and
pressure conditions is explored by conducting atomistic molecular dynamics (MD) …