Classical dynamical density functional theory: from fundamentals to applications

M te Vrugt, H Löwen, R Wittkowski - Advances in Physics, 2020 - Taylor & Francis
Classical dynamical density functional theory (DDFT) is one of the cornerstones of modern
statistical mechanics. It is an extension of the highly successful method of classical density …

The statistical mechanics of dynamic pathways to self-assembly

S Whitelam, RL Jack - Annual review of physical chemistry, 2015 - annualreviews.org
This review describes some important physical characteristics of the pathways (ie,
dynamical processes) by which molecular, nanoscale, and micrometer-scale self-assembly …

Out-of-equilibrium processes in crystallization of organic-inorganic perovskites during spin coating

S Pratap, F Babbe, NS Barchi, Z Yuan, T Luong… - Nature …, 2021 - nature.com
Complex phenomena are prevalent during the formation of materials, which affect their
processing-structure-function relationships. Thin films of methylammonium lead iodide …

How crystals form: A theory of nucleation pathways

JF Lutsko - Science advances, 2019 - science.org
Recent advances in classical density functional theory are combined with stochastic process
theory and rare event techniques to formulate a theoretical description of nucleation …

Heterogeneous nucleation of ice on carbon surfaces

L Lupi, A Hudait, V Molinero - Journal of the American Chemical …, 2014 - ACS Publications
Atmospheric aerosols can promote the heterogeneous nucleation of ice, impacting the
radiative properties of clouds and Earth's climate. The experimental investigation of …

The microscopic pathway to crystallization in supercooled liquids

J Russo, H Tanaka - Scientific reports, 2012 - nature.com
Despite its fundamental and technological importance, a microscopic understanding of the
crystallization process is still elusive. By computer simulations of the hard-sphere model we …

[HTML][HTML] Phase-field modeling of crystal nucleation in undercooled liquids–A review

L Gránásy, GI Tóth, JA Warren, F Podmaniczky… - Progress in Materials …, 2019 - Elsevier
We review how phase-field models contributed to the understanding of various aspects of
crystal nucleation, including homogeneous and heterogeneous processes, and their role in …

Formation of calcium sulfate through the aggregation of sub-3 nanometre primary species

TM Stawski, AE Van Driessche, M Ossorio… - Nature …, 2016 - nature.com
The formation pathways of gypsum remain uncertain. Here, using truly in situ and fast time-
resolved small-angle X-ray scattering, we quantify the four-stage solution-based nucleation …

Observing classical nucleation theory at work by monitoring phase transitions with molecular precision

M Sleutel, J Lutsko, AES Van Driessche… - Nature …, 2014 - nature.com
It is widely accepted that many phase transitions do not follow nucleation pathways as
envisaged by the classical nucleation theory. Many substances can traverse intermediate …

Crystallization kinetics of colloidal model suspensions: recent achievements and new perspectives

T Palberg - Journal of Physics: Condensed Matter, 2014 - iopscience.iop.org
Colloidal model systems allow studying crystallization kinetics under fairly ideal conditions,
with rather well-characterized pair interactions and minimized external influences. In …