Nanoporous carbon structures of different densities generated through GAP molecular dynamics
Description
These nanoporous (NP) carbon atomic structures, in extendend XYZ format, have been generated using a melt-graphitization-quench molecular dynamics (MD) protocol using a Gaussian interatomic potential (GAP) for amorphous carbon [1]. Simulation details and characterization of structural and mechanical properties will follow shortly in a scientific paper.
References
[1] M.A. Caro. GAP interatomic potential for amorphous carbon (2.0) [Data set]. Zenodo, 10.5281/zenodo.5243184 (2021).
Show moreYear of publication
2021
Authors
Department of Applied Physics
Miguel A. Caro - Creator
Yanzhou Wang - Creator
Zenodo - Publisher
Other information
Fields of science
Nanotechnology
Open access
Open
License
Creative Commons Attribution 4.0 International (CC BY 4.0)