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Chin. Phys. B, 2021, Vol. 30(7): 076102    DOI: 10.1088/1674-1056/abf113
CONDENSED MATTER: STRUCTURAL, MECHANICAL, AND THERMAL PROPERTIES Prev   Next  

Non-monotonic temperature evolution of nonlocal structure-dynamics correlation in CuZr glass-forming liquids

W J Jiang(江文杰) and M Z Li(李茂枝)
Department of Physics and Beijing Key Laboratory of Opto-electronic Functional Materials & Micro-nano Devices, Renmin University of China, Beijing 100872, China
Abstract  The structure-dynamics correlations in a nonlocal manner were investigated in CuZr metallic glass-forming liquids via classical molecular dynamics simulations. A spatial coarse-graining approach was employed to incorporate the nonlocal structural information of given structural order parameters in the structure-dynamics relationship. It is found that the correlation between structure order parameters and dynamics increases with increasing coarse-graining length and has a characteristic length scale. Moreover, the characteristic correlation length exhibits a non-monotonic temperature evolution as temperature approaches glass transition temperature, which is not sensitive to the considered structure order parameters. Our results unveil a striking change in the structure-dynamics correlation, which involves no fitting theoretical interpretation. These findings provide new insight into the structure-dynamics correlation in glass transition.
Keywords:  metallic glass-forming liquid      structure-dynamics correlation      molecular dynamics simulation  
Received:  09 February 2021      Revised:  16 March 2021      Accepted manuscript online:  23 March 2021
PACS:  61.43.Dq (Amorphous semiconductors, metals, and alloys)  
  64.70.pe (Metallic glasses)  
Fund: Project supported by the National Natural Science Foundation of China (Grant Nos. 52031016 and 51631003).
Corresponding Authors:  M Z Li     E-mail:  maozhili@ruc.edu.cn

Cite this article: 

W J Jiang(江文杰) and M Z Li(李茂枝) Non-monotonic temperature evolution of nonlocal structure-dynamics correlation in CuZr glass-forming liquids 2021 Chin. Phys. B 30 076102

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