Title | Density functional theory study on the effect of OH and Cl adsorption on the surface structure of α-Fe2O3 |
Publication Type | Journal Article |
Year of Publication | 2017 |
Authors | Pang, Q, DorMohammadi, H, O. Isgor, B, Árnadóttir, L |
Journal | Computational and Theoretical Chemistry |
Volume | 1100 |
Pagination | 91 - 101 |
Date Published | Jan-01-2017 |
ISSN | 2210271X |
URL | https://www.sciencedirect.com/science/article/abs/pii/S2210271X16304959 |
DOI | 10.1016/j.comptc.2016.12.009 |
Short Title | Computational and Theoretical Chemistry |