Photo-induced hydrophilicity at the ZnO(112̄0) surface: an evolutionary algorithm-aided density functional theory study
Evolutionary algorithm-aided density functional theory calculations were utilized to determine the stable adsorption structures of H2O at ZnO(112̄0) extensively under different coverages. By decomposing the adsorption energetics, we illustrate that H2O dissociation to a large extent is actually hamp...
Saved in:
| Published in: | Physical chemistry chemical physics : PCCP Vol. 23; no. 35; p. 19790 |
|---|---|
| Main Authors: | , , |
| Format: | Journal Article |
| Language: | English |
| Published: |
15.09.2021
|
| ISSN: | 1463-9084, 1463-9084 |
| Online Access: | Get more information |
| Tags: |
Add Tag
No Tags, Be the first to tag this record!
|
Be the first to leave a comment!