Atomistic Simulations

NIST Repository

Materials Data Repository will be down tomorrow, Friday October 20th, in the morning for a system upgrade. We thank you for your patience as we try to improve our service.

Atomistic Simulations

 

Atomistic simulations (e.g. molecular dynamics) model material behavior at the atomic level. The motion of the atoms is simulated by evolving the atomic configuration in time according to Newton's equation (F=ma).

Recent Submissions