Active Project

Electronic Structure Studies of Transparent Semiconductors

Project details

Project title: Electronic Structure Studies of Transparent Semiconductors
Project code: tcche003b
Project class: B

Start date: Wednesday 13 August 2008
End date: Thursday 12 August 2010

People

Project PI: Prof. Graeme Watson
Number of users: 2-5
Registered users: 4

Resulting publications

• Acceptor Levels in p-Type Cu₂O: Rationalizing Theory and Experiment
• Modeling the polaronic nature of p-type defects in Cu₂O: The failure of GGA and GGA+U
• Understanding the p-Type Conduction Properties of the Transparent Conducting Oxide CuBO₂: A Density Functional Theory Analysis
• Understanding conductivity in SrCu2O2: stability, geometry and electronic structure of intrinsic defects from first principles
• Understanding conductivity anomalies in CuI-based delafossite transparent conducting oxides: Theoretical insights
• Comparative study of bandwidths in copper delafossites from x-ray emission spectroscopy
• (Cu2S2)(Sr3SC2O5)-A Layered, Direct Band Gap, p-Type Transparent Conducting Oxychalcogenide: A Theoretical Analysis.

Allocated resources