Testing the validity of Adam–Gibbs equation

The Adam–Gibbs (AG) equation may be one of the most influential models in the study of α-relaxation. In this paper, we derived mathematical relationships governing changes in the potential barrier and configurational entropy from a series of nonlinearly scaled potential energy landscapes. By integrating these relationships with molecular dynamics simulations, we revisited the renowned AG model, which establishes a direct correlation between the α-relaxation time, configurational entropy, and potential barrier. Our findings confirm that the AG model effectively depicts the temperature dependence of the α-relaxation time. Additionally, we reassessed other widely used models for α-relaxation, including the Vogel–Fulcher–Tammann model, the shoving model, the Mauro–Yue–Ellison–Gupta–Allan model, and various quadratic-form models, to evaluate their applicability under varying potential barriers. Our results indicate that the potential barrier plays a critical role in these relaxation models. These models perform well when the average potential barrier is high. However, discrepancies arise when the average potential barrier decreases. This research provides an in-depth analysis of α-relaxation, offering new insights into the dynamics of supercooled liquids.

Authors

Institutions

Publication Details

Journal
Journal of Applied Physics
Published
2025-02-13
DOI
https://doi.org/10.1063/5.0243030
Citations
1
Primary Topic
Material Dynamics and Properties
Type
article
Field-Weighted Citation Impact
0.52

Funders

Controls
|||
ALL TIME
JAN
FEB
MAR
APR
MAY
JUN
JUL
AUG
SEP
OCT
article

Testing the validity of Adam–Gibbs equation

D. Y. Sun, B. Zhang, D. M. Zhang, Xin Gong
1 citations
Journal of Applied Physics
Material Dynamics and Properties
0.52
article

Testing the validity of Adam–Gibbs equation

D. Y. Sun, B. Zhang, D. M. Zhang, Xin Gong
article en
1 citations

Abstract

The Adam–Gibbs (AG) equation may be one of the most influential models in the study of α-relaxation. In this paper, we derived mathematical relationships governing changes in the potential barrier and configurational entropy from a series of nonlinearly scaled potential energy landscapes. By integrating these relationships with molecular dynamics simulations, we revisited the renowned AG model, which establishes a direct correlation between the α-relaxation time, configurational entropy, and potential barrier. Our findings confirm that the AG model effectively depicts the temperature dependence of the α-relaxation time. Additionally, we reassessed other widely used models for α-relaxation, including the Vogel–Fulcher–Tammann model, the shoving model, the Mauro–Yue–Ellison–Gupta–Allan model, and various quadratic-form models, to evaluate their applicability under varying potential barriers. Our results indicate that the potential barrier plays a critical role in these relaxation models. These models perform well when the average potential barrier is high. However, discrepancies arise when the average potential barrier decreases. This research provides an in-depth analysis of α-relaxation, offering new insights into the dynamics of supercooled liquids.

Journal of Applied PhysicsVol. 137(6)
Fudan University (CN), Computational Physics (United States) (US), East China Normal University (CN)
National Natural Science Foundation of China, National Key Research and Development Program of China
Openalex Percentile: Top 42%
Material Dynamics and Properties
0.52
AI Navigator

Ask Laika to Summarize, Analyze, and Connect papers live on the map.

Summarize Papers & Methodologies

Extract key findings, datasets, and comparative methods across publications.

Benchmark Rankings & Visual Analytics

Rank top research institutions, authors, funders, topics, and journals by Field-Weighted Citation Impact (FWCI) and paper volume with instant charts.

Connect Distant Disciplines

Bridge topological clusters on the map to find hidden collaborative intersections.