A carregar...
Test of the Transferability of the Specific Reaction Parameter Functional for H(2) + Cu(111) to D(2) + Ag(111)
[Image: see text] The accurate description of the dissociative chemisorption of a molecule on a metal surface requires a chemically accurate description of the molecule–surface interaction. Previously, it was shown that the specific reaction parameter approach to density functional theory (SRP–DFT)...
Na minha lista:
| Publicado no: | J Phys Chem C Nanomater Interfaces |
|---|---|
| Main Authors: | , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
American Chemical
Society
2018
|
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6189907/ https://ncbi.nlm.nih.gov/pubmed/30344838 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jpcc.8b05658 |
| Tags: |
Adicionar Tag
Sem tags, seja o primeiro a adicionar uma tag!
|