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Despite great efforts over the past 50 years, the simulation of water still presents significant challenges and open questions. At room temperature and pressure, the collective molecular interactions and dynamics of water molecules may form…

Chemical Physics · Physics 2022-06-22 Riccardo Capelli , Francesco Muniz-Miranda , Giovanni M. Pavan

We investigate the phase behavior of a single-component system in 3 dimensions with spherically-symmetric, pairwise-additive, soft-core interactions with an attractive well at a long distance, a repulsive soft-core shoulder at an…

Soft Condensed Matter · Physics 2009-11-07 G. Franzese , G. Malescio , A. Skibinsky , S. V. Buldyrev , H. E. Stanley

The discovery of high-density liquid (HDL) and low-density liquid (LDL) water has been a major success of molecular simulations, yet extending this analysis to interfacial water is challenging due to conventional order parameters assuming…

Soft Condensed Matter · Physics 2025-09-03 Pal Jedlovszky , Christoph Dellago , Marcello Sega

Glasses and gels are the two dynamically arrested, disordered states of matter. Despite their importance, their similarities and differences remain elusive, especially at high density. We identify dynamical and structural signatures which…

Soft Condensed Matter · Physics 2014-09-22 C. Patrick Royall , Stephen R. Williams , Hajime Tanaka

"Fluid polyamorphism" is the existence of different condensed amorphous states in a single-component fluid. It is either found or predicted, usually at extreme conditions, for a broad group of very different substances, including helium,…

We investigate bulk thermodynamic and microscopic structural properties of amorphous solids in the framework of the phase-field crystal (PFC) model. These are metastable states with a non-uniform density distribution having no long-range…

Soft Condensed Matter · Physics 2024-09-11 Shaho Abdalla , Andrew J. Archer , László Gránásy , Gyula I. Tóth

Few questions in condensed matter science have proven as difficult to unravel as the interplay between structure and dynamics in supercooled liquids and glasses. The conundrum: close to the glass transition, the dynamics slow down…

The plasticity of amorphous solids undergoing shear is characterized by quasi-localized rearrangements of particles. While many models of plasticity exist, the precise relationship between plastic dynamics and the structure of a particle's…

Soft Condensed Matter · Physics 2024-06-12 Jason W. Rocks , Sean A. Ridout , Andrea J. Liu

Elucidating the nature of the glass transition has been the holy grail of condensed matter physics and statistical mechanics for several decades. A phenomenological aspect that makes glass formation a conceptually formidable problem is that…

Soft Condensed Matter · Physics 2016-08-11 Shreyas Gokhale , K. Hima Nagamanasa , A. K. Sood , Rajesh Ganapathy

The universal anomalous vibrational and thermal properties of amorphous solids are believed to be related to the local variations of the elasticity. Recently it has been shown that the vibrational properties are sensitive to the glass's…

Soft Condensed Matter · Physics 2019-09-30 Alireza Shakerpoor , Elijah Flenner , Grzegorz Szamel

Amorphous solids are mechanically rigid while possessing a disordered structure similar to that of dense liquids. Recent research indicates that dynamical heterogeneity, spatio-temporal fluctuations in local dynamical behavior, might help…

Statistical Mechanics · Physics 2011-06-10 Ludovic Berthier

We connect the configurational entropy of a liquid to the geometrical properties of its local energy landscape, using a high-temperature expansion. It is proposed that correlations between local structures arises from their overlap and,…

Soft Condensed Matter · Physics 2016-08-24 Pierre Ronceray , Peter Harrowell

A definition of structural diversity, adapted from the biodiversity literature, is introduced to provide a general characterization of structures of condensed matter. Using the Favored Local Structure (FLS) lattice model as a testbed, the…

Materials Science · Physics 2024-08-16 Yueran Wang , Peter Harrowell

Understanding the physics of supercooled liquids near glassy transition remains one of the major challenges in condensed matter science. There has been long recognized that supercooled liquids have spatially dynamical heterogeneity whose…

Statistical Mechanics · Physics 2023-07-10 Viet Nguyen , Xueyu Song

We use computer simulations to study the microscopic dynamics of an athermal assembly of soft particles near the fluid-to-solid, jamming transition. Borrowing tools developed to study dynamic heterogeneity near glass transitions, we…

Materials Science · Physics 2010-06-24 Claus Heussinger , Ludovic Berthier , Jean-Louis Barrat

The structural evolution with temperature of pure silica (SiO2), sodium-silicate (5Na2O-95SiO2, 10Na2O-90SiO2 and 25Na2O-75SiO2) and albite (15Na2O-15Al2O3-75SiO2) glasses previously densified from hot compression is monitored with a…

Weather regimes provide a useful framework for describing large-scale atmospheric variability and its impacts on regional weather. Despite extensive study, there is still no universally accepted definition or method for identifying weather…

Algebraic Topology · Mathematics 2026-05-21 Soheil Anbouhi

The structural dynamics of ice in the freezing - thawing process has been studied in the context of the concept of two-phase water. It was previously shown that water is a two-phase system consisting of free and bound (liquid crystal)…

Soft Condensed Matter · Physics 2018-11-21 T. Yakhno , V. Yakhno

We use machine learning methods on local structure to identify flow defects - or regions susceptible to rearrangement - in jammed and glassy systems. We apply this method successfully to two disparate systems: a two dimensional experimental…

Amorphous systems have rapidly gained promise as novel platforms for topological matter. In this work we establish a scaling theory of amorphous topological phase transitions driven by the density of lattice points in two dimensions. By…

Mesoscale and Nanoscale Physics · Physics 2020-01-22 Isac Sahlberg , Alex Westström , Kim Pöyhönen , Teemu Ojanen