Hydrogen adsorption of nitrogen-doped carbon nanotubes functionalized with 3d-block transition metals
A systematic study of the most stable configurations, calculation of the corresponding binding and free energies of functionalized 3d transition metals (TMs) on (10,0) Single Walled Carbon Nanotube (SWCNT) doped with porphyrin-like nitrogen defects (4ND-CNxNT) using spin-polarized density functional...
Saved in:
| Main Author: | |
|---|---|
| Format: | text |
| Published: |
Animo Repository
2015
|
| Subjects: | |
| Online Access: | https://animorepository.dlsu.edu.ph/faculty_research/2210 https://animorepository.dlsu.edu.ph/context/faculty_research/article/3209/type/native/viewcontent |
| Tags: |
Add Tag
No Tags, Be the first to tag this record!
|
| Institution: | De La Salle University |