COMPUTATIONAL STUDY OF THE INTERACTION OF BROMIN SPECIES WITH TiO2
Reverse reaction in the photocatalytic process on TiOO2 surface by electrolyte species becomes an important discussion because it is one of the factors that limiting the effeciency, especially in the application of dye-sensitiez solar cell (DSSC). Computational calculations with density functional t...
Saved in:
| Main Author: | |
|---|---|
| Format: | Final Project |
| Language: | Indonesia |
| Online Access: | https://digilib.itb.ac.id/gdl/view/16500 |
| Tags: |
Add Tag
No Tags, Be the first to tag this record!
|
| Institution: | Institut Teknologi Bandung |
| Language: | Indonesia |
| Summary: | Reverse reaction in the photocatalytic process on TiOO2 surface by electrolyte species becomes an important discussion because it is one of the factors that limiting the effeciency, especially in the application of dye-sensitiez solar cell (DSSC). Computational calculations with density functional theory (DFT) have been carried out to study the reserve reaction of bromine species on the surface of TiO2. The calculations involved two main polymorrph of TiO2, namely rutile (110) and anatase (101) using periodic slab model |
|---|