Knowledge of uncertainties is a key requirement for the acceptance of molecular simulation as part of an engineering toolkit. One of the main sources of uncertainty in a molecular simulation is the force field (interatomic potential) used to model the material. We will discuss our efforts to provide researchers with useful information to help th...
Creator:
Becker, Chandler (National Institute of Standards and Technology)
Created:
2013-12-16
Contributed By:
University of Minnesota, Institute for Mathematics and its Applications.