Modeling of single-walled carbon nanotubes functionalized with carboxylic and amide groups towards its solubilization in water
The paper discusses the impact of functionalization on understanding the solubility of a single-walled carbon nanotube (SWCNT) to increase its dispersion in water, with the aide of spin-unrestricted density functional theory (DFT). A finite (10, 0) zigzag nanotube model containing 80 C atoms saturat...
Saved in:
| Main Author: | |
|---|---|
| Format: | text |
| Published: |
Animo Repository
2015
|
| Subjects: | |
| Online Access: | https://animorepository.dlsu.edu.ph/faculty_research/2207 https://animorepository.dlsu.edu.ph/context/faculty_research/article/3206/type/native/viewcontent |
| Tags: |
Add Tag
No Tags, Be the first to tag this record!
|
| Institution: | De La Salle University |