Retraction:'Theoretical investigation of the dissociation dynamics of vibrationally excited vinyl bromide on an ab initio potential-energy surface obtained using modified novelty sampling and feed-forward neural networks'[J.Chem.Phys.124,054321 (2006

摘要

The above paper describes in detail the procedures required for the implementation of a method that permits molecular dynamics calculations to be executed with an ab initio potential-energy surface obtained using a modified novelty sampling procedure coupled with feed-forward neural networks.The paper concludes with the presentation of an example application of the method to the dissociation dynamics of vibrationally excited vinyl bromide.