Search results for "Phase change"

Structural phase transitions on the nanoscale: The crucial pattern in the phase-change materialsGe2Sb2Te5and GeTe

2007

Phase-change materials are of immense importance for optical recording and computer memory, but the structure of the amorphous phases and the nature of the phase transition in the nanoscale bits pose continuing challenges. Massively parallel density functional simulations have been used to characterize the amorphous structure of the prototype materials ${\mathrm{Ge}}_{2}{\mathrm{Sb}}_{2}{\mathrm{Te}}_{5}$ and GeTe. In both, there is long-ranged order among Te atoms and the crucial structural motif is a four-membered ring with alternating atoms of types $A$ (Ge and Sb) and $B$ (Te), an ``$ABAB$ square.'' The rapid amorphous-to-crystalline phase change is a reorientation of disordered $ABAB$ …

The impact of thermophysical properties and hysteresis effects on the energy performance simulation of PCM wallboards: Experimental studies, modellin…

2020

Abstract This paper presents a combined experimental and numerical procedure, developed to test the thermophysical behaviour of a real scale PCM wallboard, aiming at providing reliable data for the validation of building energy performance simulation tools. Data obtained from two experimental tests, conducted on real building elements integrating PCM undergoing complete and incomplete phase change, are considered for assessing the impact of thermal properties and hysteresis. A comprehensive comparative numerical analysis, performed by means of an in-house developed simulation tool, called DETECt, is carried out to investigate the reliability of several modelling and simulation approaches av…

How can freezing water burst pipes and containers?

2018

When a water pipe or a tank completely filled with water is cooled, ice formation generates a pressure which can cause it to burst. This phenomenon is due to the fact that water increases in volume when freezing—but how to explain the expansion force of freezing water? Our aim in this paper is to show that in the case of a total phase change, even the best steels could not prevent bursting. It is also to show how ice formation occurs in isochoric cooling (constant volume) when a container that is full of water is strong enough to prevent water expansion. At the end of the paper, we give some examples taken from everyday life.

First-principles study of the amorphous In3SbTe2phase change compound

2013

Ab initio molecular dynamics simulations based on density functional theory were performed to generate amorphous models of the phase change compound In${}_{3}$SbTe${}_{2}$ by quenching from the melt. In-Sb and In-Te are the most abundant bonds with only a minor fraction of Sb-Te bonds. The bonding geometry in the amorphous phase is, however, strongly dependent on the density in the range 6.448--5.75 g/cm${}^{3}$ that we investigated. While at high density the bonding geometry of In atoms is mostly octahedral-like as in the cubic crystalline phase of the ternary compound In${}_{3}$SbTe${}_{2}$, at low density we observed a sizable fraction of tetrahedral-like geometries similar to those pres…

BUILDING INTEGRATED PHASE CHANGE MATERIALS ENERGY STORAGE: EXPERIMENTAL STUDIES, MODELLING AND PARAMETRIC ANALYSIS

Estimating the temperature evolution of foodstuffs during freezing with a 3D meshless numerical method

2015

Abstract Freezing processes are characterised by sharp changes in specific heat capacity and thermal conductivity for temperatures close to the freezing point. This leads to strong nonlinearities in the governing PDE that may be difficult to resolve using traditional numerical methods. In this work we present a meshless numerical method, based on a local Hermite radial basis function collocation approach in finite differencing mode, to allow the solution of freezing problems. By introducing a Kirchhoff transformation and solving the governing equations in Kirchhoff space, the strength of nonlinearity is reduced while preserving the structure of the heat equation. In combination with the hig…

Transient guided-mode resonance metasurfaces with phase-transition materials

2023

We investigate transient, photo-thermally induced metasurface effects in a planar thin-film multilayer based on a phase-transition material. Illumination of a properly designed multilayer with two obliquely incident and phase-coherent pulsed pumps induces a transient and reversible temperature pattern in the phase-transition layer. The deep periodic modulation of the refractive index, caused by the interfering pumps, produces a transient Fano-like spectral feature associated with a guided-mode resonance. A coupled opto-thermal model is employed to analyze the temporal dynamics of the transient metasurface and to evaluate its speed and modulation capabilities. Using near-infrared pump pulses…