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Quantum capacitance, electrostatic potential, electronic and structural data for bare and functionalized niobium carbide MXenes

The data reported in this article are structural and physicochemical properties for bare and F, O, OH and CH(3)O-functionalized Nb(n+1)C(n) (n = 1, 2, 3 and 4) MXenes. The structural properties are presented as top views and side views from the X direction of the optimal structures of studied MXenes...

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Enregistré dans:
Détails bibliographiques
Publié dans:Data Brief
Auteurs principaux: Xin, Yan, Yu, Yang-Xin
Format: Artigo
Langue:Inglês
Publié: Elsevier 2017
Sujets:
Accès en ligne:https://ncbi.nlm.nih.gov/pmc/articles/PMC5671486/
https://ncbi.nlm.nih.gov/pubmed/29124085
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.dib.2017.10.003
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