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Updated: Jun 12, 2026

Characterization of Thermal Transport in One-dimensional Solid Materials
05:20

Characterization of Thermal Transport in One-dimensional Solid Materials

Published on: January 26, 2014

重温多体相互作用热电流和热导电计算,使用时刻电位电位/LAMMPS接口

Siu Ting Tai1, Chen Wang2, Ruihuan Cheng1

  • 1Department of Mechanical Engineering, The University of Hong Kong, Pokfulam Road, Hong Kong SAR, China.

Journal of chemical theory and computation
|March 29, 2025
PubMed
概括

机器学习潜力 (MLP) 需要准确的多体相互作用来计算晶格导热率. 这项研究将多体热电流描述集成到瞬间张量潜力中,显著影响热导率结果.

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