Title: Computer-aided design of zinc phosphide heterojunctions for efficient solar energy conversion
Funder
Engineering and Physical Sciences Research Council
Principal Investigator
Project Details
Net value award figure for Cardiff University: £525,254.00
Start date: 29/06/2018
End date: 13/04/2025
- First-Principles Density Functional Theory Characterisation of the Adsorption Complexes of H3AsO3 on Cobalt Ferrite (Fe2CoO4) Surfaces - data (2021)
- First-principles DFT Insights into the Adsorption of Hydrazine on Bimetallic β1-NiZn Catalyst: Implications for Direct Hydrazine Fuel Cells - data (2020)
- First-Principles Insights into the Electronic Structure, Optical and Band Alignment Properties of Earth-Abundant Cu2SrSnS4 Solar Absorber - data (2021)
- First–principles Investigation of the Structural, Elastic, Electronic, and Optical Properties of α– and β–SrZrS3: Implications for Photovoltaic Applications (2020)
- First-Principles Mechanistic Insights into the Hydrogen Evolution Reaction on Ni2P Electrocatalyst in Alkaline Medium (2020)



