| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5422005 | Surface Science | 2015 | 5 Pages |
Abstract
We study the surface structure of the (111) dipolar face of LiF and calculate the thermal contribution to the surface energy at the Hartree-Fock level. The surface free energy at 0Â K of the Li and F terminated (111) faces are 0.767 and 0.698Â J/m2, respectively while at 298Â K, are 0.663 (Li terminated) and 0.612 (F terminated) J/m2.152
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Marco Rubbo, Marco Bruno, Mauro Prencipe,