Design Principles for Metal-Coordinated Frameworks as Electrocatalysts for Energy Storage and Conversion
In this dissertation, density functional theory calculations are performed to calculate the thermodynamic and electrochemical properties of metal coordinated frameworks for oxygen reduction reaction (ORR) and oxygen evolution reaction (OER). Gibb's free energy, overpotential, charge transfer an...
| Main Author: | |
|---|---|
| Other Authors: | |
| Format: | Others |
| Language: | English |
| Published: |
University of North Texas
2018
|
| Subjects: | |
| Online Access: | https://digital.library.unt.edu/ark:/67531/metadc1404610/ |