Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5385199 | Chemical Physics Letters | 2010 | 4 Pages |
Abstract
⺠Complete basis set extrapolation by PNOF3 for C singlet and triplet states. ⺠High-accuracy compared to CCSD(T) results. ⺠CCSD(T) values are lower-bounds.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
J.M. Matxain, M. Piris, X. Lopez, J.M. Ugalde,