Why neural functionals suit statistical mechanics

F Sammüller, S Hermann… - Journal of Physics …, 2024 - iopscience.iop.org
We describe recent progress in the statistical mechanical description of many-body systems
via machine learning combined with concepts from density functional theory and many-body …

Melting is well-known, but is it also well-understood?

G de With - Chemical Reviews, 2023 - ACS Publications
Contrary to continuous phase transitions, where renormalization group theory provides a
general framework, for discontinuous phase transitions such a framework seems to be …

Perspective: How to overcome dynamical density functional theory

D de Las Heras, T Zimmermann… - Journal of Physics …, 2023 - iopscience.iop.org
We argue in favour of develo** a comprehensive dynamical theory for rationalizing,
predicting, designing, and machine learning nonequilibrium phenomena that occur in soft …

Comparative study of force-based classical density functional theory

F Sammüller, S Hermann, M Schmidt - Physical Review E, 2023 - APS
We reexamine results obtained with the recently proposed density functional theory
framework based on forces (force-DFT)[SM Tschopp, Phys. Rev. E 106, 014115 (2022) 2470 …

Multiscale modelling of biopolymers

A Scacchi, M Vuorte, M Sammalkorpi - Advances in Physics: X, 2024 - Taylor & Francis
This review overviews common biopolymer modelling approaches ranging from chemically
specific to highly coarse-grained techniques, along with their application ranges, strengths …

[HTML][HTML] Mesoscale modeling of deformations and defects in thin crystalline sheets

L Benoit–Maréchal, I Nitschke, A Voigt… - Mechanics of Materials, 2024 - Elsevier
We present a mesoscale description of deformations and defects in thin, flexible sheets with
crystalline order, tackling the interplay between in-plane elasticity, out-of-plane deformation …

Derivation and analysis of a phase field crystal model for a mixture of active and passive particles

M te Vrugt, MP Holl, A Koch… - … and Simulation in …, 2022 - iopscience.iop.org
We discuss an active phase field crystal (PFC) model that describes a mixture of active and
passive particles. First, a microscopic derivation from dynamical density functional theory is …

Tuning nonequilibrium colloidal structure in external fields by density-dependent state switching

L Heinen, S Groh, J Dzubiella - Physical Review E, 2024 - APS
Biological cells have the ability to switch internal states depending on the density of other
cells in their local environment, referred to as “quorum sensing.” The latter can be utilized to …

Biaxial nematic order in fundamental measure theory

A El Moumane, M Te Vrugt, H Löwen… - The Journal of Chemical …, 2024 - pubs.aip.org
Liquid crystals consisting of biaxial particles can exhibit a much richer phase behavior than
their uniaxial counterparts. Usually, one has to rely on simulation results to understand the …

[PDF][PDF] A review of active matter reviews

M te Vrugt, R Wittkowski - arxiv preprint arxiv:2405.15751, 2024 - researchgate.net
In the past years, the amount of research on active matter has grown extremely rapidly, a fact
that is reflected in particular by the existence of more than 600 review articles on this topic …