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Towards quantum corrosion chemistry: screening perfect Cr, Ni sites and stoichiometry on top of an Fe(110) surface using DFT
For decades, corrosion has been classified into many categories according to the microstructural morphology of the chemical reaction products. Until recently, the development of quantum chemistry has simplified the fundamental corrosion mechanism into only two processes: electrochemical dissolution...
| Autores principales: | , , , , , , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
The Royal Society of Chemistry
2023
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10055913/ https://www.ncbi.nlm.nih.gov/pubmed/37006345 http://dx.doi.org/10.1039/d2ra07463j |