| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5380054 | Chemical Physics Letters | 2015 | 6 Pages |
Abstract
- Interaction energies evaluated for n-alkanes dimers (C1-C10) using different methods.
- Relationships between interaction energies calculated from different theoretical methods.
- Extrapolation of thermodynamic properties (ÎHv and Tc) using interaction energy correlations.
- Interaction and dispersion energy in DFT-D.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Laura Rojas, Fernando Ruette, Alexander Peraza, Olga Castellano, Humberto Soscún,