| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5389104 | Chemical Physics Letters | 2007 | 7 Pages |
Abstract
The BP86, B3P86 and PBE functionals provides reliable energetic results comparable with the CCSD(T)//CISD level of theory.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Valber D. Silva, Roberta P. Dias, Willian R. Rocha,