Published October 22, 2019
| Version v1
Dataset
Open
Descriptors for Electron and Hole Charge Carriers in Metal Oxides: Calculations Dataset
Authors/Creators
- 1. Imperial College London
- 2. University College London
- 3. University of Bath
Description
Calculation dataset required in order to carry out the full analysis in This repository. Outputs from hybrid Density Functional Theory calculations using the Vienna Ab-initio Simulation Package (VASP) are provided. See the main repository for details on analysis steps.