Description
The dataset contains inputs and outputs for a series of VASP calculations on Mg/Li-intercalated F-doped anatase TiO2, and scripts for processing this DFT data to produce the related manuscript figures.
Date made available | 24 Oct 2019 |
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Publisher | University of Bath |
Cite this
Morgan, B. (Creator) (24 Oct 2019). Computational Supporting Dataset for "Exploiting Cationic Vacancies for Increased Energy Densities in Dual-Ion Batteries". University of Bath. 10.15125/BATH-00689