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Descriptors for Electron and Hole Charge Carriers in Metal Oxides: Calculations Dataset
Author(s)
Davies, Daniel W
Savory, Christopher N
Frost, Jarvist
Scanlon, David O
Morgan, Benjamin M
Type
Dataset
Abstract
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.
Version
1
Date Issued
2019-10-22
Citation
2019
URI
DOI
Copyright Statement
http://creativecommons.org/licenses/by/4.0/legalcode
Subjects
Descriptors
Electron
Hole Charge Carriers
Metal Oxides