| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5375338 | Chemical Physics | 2009 | 5 Pages |
Abstract
We also developed the additivity scheme to find a connection between Shannon entropy and molecular correlation energy. The estimated molecular correlation energies show an excellent agreement with those obtained by elaborate G3 method with R2Â =Â 0.990.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Afshan Mohajeri, Mojtaba Alipour,