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In binary metallic systems like the Pd--Er alloys charged with hydrogen the observed structure evolution exhibits complex dynamics. It is characterized by non-monotonic time variations in an Er-rich fraction respect with an Er-poor fraction…

Materials Science · Physics 2007-05-23 A. A. Katsnelson , A. Yu. Lavrenov , I. A. Lubashevsky

We have proposed a qualitative model for the structure of binary systems similar to Pd-Er alloys, which explains their nonmonotonic relaxation after the hydrogen saturation. It is based on the assumption that such a solid solution involves…

Materials Science · Physics 2007-05-23 A. A. Katsnelson , I. A. Lubashevskiy , A. Yu. Lavrenov

The activity of metal catalysts depends sensitively on dynamic structural changes that occur during operating conditions. The mechanistic understanding underlying such transformations in small Pt nanoparticles (NPs) of $\sim1-5$ nm in…

X-rays diffraction pictures time dependence of deformed alloy Pd-Ta being charged with hydrogen has been shown to be possibly caused by multi-pits character of energetic relief in the states space. Phenomenological model representing alloy…

It is observed that low-lying transitions of an interstitial hydrogen adatom on a metallic lattice correspond classically to dipoles oscillating at frequencies where band electrons typically have a low electromagnetic absorption. Such…

Materials Science · Physics 2007-05-23 J. S. Brown

The ground and excited vibrational states for the three hydrogen isotopes on the Pd(111) surface have been calculated. Notable features of these states are the high degree of anharmonicity, which is most prominently seen in the weak…

chem-ph · Physics 2009-10-22 Steven W. Rick , J. D. Doll

We present a hydro-geomechanical model for subsurface methane hydrate systems. Our model considers kinetic hydrate phase change and non-isothermal, multi-phase, multi-component flow in elastically deforming soils. The model accounts for the…

Numerical Analysis · Mathematics 2015-08-07 Shubhangi Gupta , Rainer Helmig , Barbara Wohlmuth

We investigate pattern transformations of periodic hydrogel systems that are triggered by swelling-induced structural instabilities. The types of microstructures considered in the present work include single-phase and two-phase voided…

Numerical Analysis · Mathematics 2023-05-17 Elten Polukhov , Laura Pytel , Marc-Andre Keip

The thermodynamics of phase transitions between phases that are size-mismatched but coherent differs from conventional stress-free thermodynamics. Most notably, in open systems such phase transitions are always associated with hysteresis.…

Materials Science · Physics 2022-04-26 J. Magnus Rahm , Joakim Löfgren , Paul Erhart

Due to their ability to reversibly absorb/desorb hydrogen without hysteresis, Pd--Au nanoalloys have been proposed as materials for hydrogen sensing. For sensing, it is important that absorption/desorption isotherms are reproducible and…

Materials Science · Physics 2021-08-17 J. Magnus Rahm , Joakim Löfgren , Erik Fransson , Paul Erhart

Transitions in structural heterogeneity of colloidal depletion gels formed through short-range attractive interactions are correlated with their dynamical arrest. The system is a density and refractive index matched suspension of 0.20…

Soft Condensed Matter · Physics 2009-11-11 C. J. Dibble , M. Kogan , M. J. Solomon

The dynamical arrest of gels is the consequence of a well defined structural phase transition, leading to the formation of a spanning cluster of bonded particles. The dynamical glass transition, instead, is not accompanied by any clear…

Soft Condensed Matter · Physics 2016-07-21 Raffaele Pastore , Antonio de Candia , Anallisa Fierro , Massimo Pica Ciamarra , Antonio Coniglio

The frequency dependence of dynamical conductivity of the quasi-one-dimensional structures with hydrogen bonds is studied on the basis of pseudospin-electron model. It takes into account the proton-electron interaction, external…

Statistical Mechanics · Physics 2012-04-27 R. Ya. Stetsiv

The particle motion associated to the {\alpha}-relaxation in supercooled liquids is still challenging scientists due to its difficulty to be probed experimentally. By combining synchrotron techniques, we found the existence of microscopic…

Studying crystal structures of superprotonic phases of alkali metal hydrogen sulfates and selenates, a very unusual phenomenon has been revealed. Dynamically disordered hydrogen atoms with low position occupancies are clearly seen in…

Materials Science · Physics 2009-07-23 Boris V. Merinov

Two-dimensional transition metal dichalcogenides (TMDs) usually exist in two or more structural phases with different physical properties, and can be repeatedly switched between these phases via different stimuli, making them potentially…

Materials Science · Physics 2020-04-29 Priyanka Manchanda , Pankaj Kumar , Pratibha Dev

Recent studies of the phase diagram for spherical, purely repulsive, active particles established the existence of a transition from a liquid-like to a solid-like phase analogous to the one observed in colloidal systems at thermal…

Statistical Mechanics · Physics 2020-04-30 Lorenzo Caprini , Claudio Maggi , Umberto Marini Bettolo Marconi , Matteo Paoluzzi , Andrea Puglisi

The primary distinction between solid and liquid phases is mechanical rigidity, with liquids having a disordered atomic structure that allows flow. While melting is a common phase transition, its microscopic mechanisms still remain unclear.…

Review of selected fundamental topics on the interaction between phase transformations, fracture, and other structural changes in inelastic materials is presented. It mostly focuses on the concepts developed in the author's group over last…

Materials Science · Physics 2021-08-24 Valery I. Levitas

The interplay between order and disorder is crucial across various fields, especially in understanding oscillatory phenomena. Periodic oscillations are frequently observed in heterogeneous catalysis, yet their underlying mechanisms need…

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