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Reactivity of shape-controlled crystals and metadynamics simulations locate the weak spots of alumina in water

The kinetic stability of any material in water relies on the presence of surface weak spots responsible for chemical weathering by hydrolysis. Being able to identify the atomistic nature of these sites and the first steps of transformation is therefore critical to master the decomposition processes....

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Pubblicato in:Nat Commun
Autori principali: Réocreux, R., Girel, É., Clabaut, P., Tuel, A., Besson, M., Chaumonnot, A., Cabiac, A., Sautet, P., Michel, C.
Natura: Artigo
Lingua:Inglês
Pubblicazione: Nature Publishing Group UK 2019
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Accesso online:https://ncbi.nlm.nih.gov/pmc/articles/PMC6637198/
https://ncbi.nlm.nih.gov/pubmed/31316059
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41467-019-10981-9
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