On the thermal properties of pure and defective \(\Psi\)-graphene nanotubes by molecular dynamics simulations

DOI10.1007/S10910-024-01588-7MaRDI QIDQ6203926

Zhenfeng Liu, Mengdie Li, Yafei Meng, Ke-Ke Chen, Pingfang Yuan, Yanxin Xie

Publication date: 8 April 2024

Published in: Journal of Mathematical Chemistry (Search for Journal in Brave)

zbMATH Keywords

molecular dynamicsdefectthermal conductivity\(\Psi\)-graphene nanotubes

Mathematics Subject Classification ID

Numerical and other methods in solid mechanics (74Sxx) Computer aspects of numerical algorithms (65Yxx) Applications to the sciences (65Zxx)

Cites Work

• Fast parallel algorithms for short-range molecular dynamics
• LAMMPS -- a flexible simulation tool for particle-based materials modeling at the atomic, meso, and continuum scales

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