Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5386014 | Chemical Physics Letters | 2010 | 6 Pages |
Abstract
⺠Report on a failure of the CC2 coupled-cluster method when applied to ozone. ⺠Analysis of the individual terms of the CC2 equations. ⺠Presentation of NO2- as a molecule connecting the failure of ozone to molecules without the failure.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Mathias Pabst, Andreas Köhn, Jürgen Gauss, John F. Stanton,