scholarly journals Two-step relaxation and the breakdown of the Stokes-Einstein relation in glass-forming liquids

2019 ◽  
Vol 100 (5) ◽  
Author(s):  
Baicheng Mei ◽  
Yuyuan Lu ◽  
Lijia An ◽  
Zhen-Gang Wang
2019 ◽  
Vol 20 (22) ◽  
pp. 5708 ◽  
Author(s):  
Francesco Puosi ◽  
Antonio Tripodo ◽  
Dino Leporini

Many systems, including polymers and molecular liquids, when adequately cooled and/or compressed, solidify into a disordered solid, i.e., a glass. The transition is not abrupt, featuring progressive decrease of the microscopic mobility and huge slowing down of the relaxation. A distinctive aspect of glass-forming materials is the microscopic dynamical heterogeneity (DH), i.e., the presence of regions with almost immobile particles coexisting with others where highly mobile ones are located. Following the first compelling evidence of a strong correlation between vibrational dynamics and ultraslow relaxation, we posed the question if the vibrational dynamics encodes predictive information on DH. Here, we review our results, drawn from molecular-dynamics numerical simulation of polymeric and molecular glass-formers, with a special focus on both the breakdown of the Stokes–Einstein relation between diffusion and viscosity, and the size of the regions with correlated displacements.


2020 ◽  
Vol 22 (4) ◽  
pp. 2557-2565 ◽  
Author(s):  
Qi-Long Cao ◽  
Pan-Pan Wang ◽  
Duo-Hui Huang

Molecular dynamics simulations of Ni36Zr64, Cu65Zr35 and Ni80Al20 were carried out over a broad range of temperature (900–3000 K) to investigate the Stokes–Einstein (SE) relation for glass-forming melts.


2000 ◽  
Vol 275 (3-4) ◽  
pp. 325-335 ◽  
Author(s):  
Patricia Goldstein ◽  
L.S. Garcı́a-Colı́n ◽  
L.F. del Castillo

2010 ◽  
Vol 146-147 ◽  
pp. 1463-1468
Author(s):  
Masahiro Ikeda ◽  
Masaru Aniya

The diffusion coefficient in the metallic glass-forming systems such as Pd-Cu-Ni-P exhibits a marked deviation from the Stokes-Einstein (SE) relation in the proximity of the glass transition temperature. Such a deviation is characterized by the fractional exponent p of the modified SE expression. For the material Pd43Cu27Ni10P20, it has been reported that it takes the value p = 0.75. In this work, it is shown that the value of p is highly correlated with the ratio ED / ENB, where ED and ENB are the activation energies for diffusion coefficient D and cooperativity NB defined by the Bond Strength-Coordination Number Fluctuation (BSCNF) model. The present paper reports that for the metallic glass-forming melt Pd43Cu27Ni10P20, the fractional exponent p can be calculated accurately within the framework of the BSCNF model.


1996 ◽  
Vol 455 ◽  
Author(s):  
U. Geyer ◽  
S. Schneider ◽  
Y. Qiu ◽  
M.-P. Macht ◽  
T. A. Tombrello ◽  
...  

ABSTRACTBe diffusivity data in the bulk metallic glass forming alloys Zr41.2Ti13.8Cu12.5Ni10Be22.5 and Zr46.7Ti8.3Cu7.5Ni10Be27.5 are reported for temperatures between 530K and 710K, extending up to 80K into the supercooled liquid states of the alloys. At the glass transition temperature, Tg, a change in temperature dependence of the data is observed in both alloys, and above Tg the diffusivity increases faster with temperature than below. The data in the supercooled liquid can be described by a modified Arrhenius expression containing the communal entropy of the supercooled liquid and based on a diffusion mechanism suggested earlier. The comparison with viscosity data in the supercooled liquid state of Zr46.7Ti8.3Cu7.5Ni10Be27.5 reveals a breakdown of the Stokes- Einstein relation, whereas D(T) and η(T) follow a relation close to van den Beu-kel's. The breakdown of the Stokes- Einstein relation indicates a cooperative diffusion mechanism in the supercooled liquid state of the ZrTiCuNiBe alloys.


2010 ◽  
Vol 97 (22) ◽  
pp. 221910 ◽  
Author(s):  
S. M. Chathoth ◽  
K. Samwer

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