A Deep Neural Network Potential Model for Theoretically Predicting Thermal Transport, Mechanical Properties of Multi-Layered Graphitic Carbon Nitride with Molecular Dynamics

Hongxia Li, Lang Wu, Changshun Xia, Shuiqing Huang,Meiqin Ni,Chunlin Huang,Ming Xu,Zhaohui Ruan

INTERNATIONAL COMMUNICATIONS IN HEAT AND MASS TRANSFER（2025）

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Key words

Deep potential,Thermal conductivity,Molecular dynamics,Heat transfer

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