Low and anisotropic tensile strength and thermal conductivity in the single-layer fullerene network revealed by machine-learning interatomic potentials
收藏Mendeley Data2026-04-18 收录
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资源简介：
Data for our manuscript
Energy minimized structure in VASP POSCAR, find "POSCAR"
Electron localization function for the energy minimized structure, find "ELFCAR"
LAMMPS input file, find “LAMMPS-input”
Passively fitted MTP for the evaluation of mechanical and thermal properties, find “p.mtp”
Video related to the uniaxial deformation along X and Y directions,respectively, find "Uniaxial-Deformation-X.mp4" and "Uniaxial-Deformation-Y.mp4"
创建时间：
2022-07-27
