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 CH3O-functionalized Nbn+1Cn (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. The...

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Bibliographic Details
Main Authors: Yan Xin, Yang-Xin Yu
Format: Article
Language:English
Published: Elsevier 2017-12-01
Series:Data in Brief
Online Access:http://www.sciencedirect.com/science/article/pii/S2352340917305206