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 |
|---|---|
| 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