A new hydrocarbon empirical potential for the molecular dynamics simulation of nanogear
In this paper, a new model of hydrocarbon potential energy function is developed in order to produce short range potential which is more accurate than reactive empirical bond order (REBO) potential. Short range potential is heavily used in Molecular Dynamics Simulation of nano materials as well as N...
Saved in:
| Main Authors: | , |
|---|---|
| Format: | Conference or Workshop Item |
| Published: |
2011
|
| Online Access: | http://eprints.utm.my/id/eprint/45489/ https://www.researchgate.net/publication/315600276_A_New_Hydrocarbon_Empirical_Potential_for_the_Molecular_Dynamics_Simulation_of_Nanogear |
| Tags: |
Add Tag
No Tags, Be the first to tag this record!
|
| Institution: | Universiti Teknologi Malaysia |