Cargando…
Many-Body Methods for Surface Chemistry Come of Age: Achieving Consensus with Experiments
[Image: see text] The adsorption energy of a molecule onto the surface of a material underpins a wide array of applications, spanning heterogeneous catalysis, gas storage, and many more. It is the key quantity where experimental measurements and theoretical calculations meet, with agreement being ne...
| Autores principales: | , , , , , |
|---|---|
| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2023
|
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10683001/ https://www.ncbi.nlm.nih.gov/pubmed/37948071 http://dx.doi.org/10.1021/jacs.3c09616 |