Structure-Property Relationship in Polyethylene Reinforced by Polyethylene-Grafted Multi-Walled Carbon Nanotubes

2008 ◽  
Vol 8 (4) ◽  
pp. 1790-1796 ◽  
Author(s):  
Valerio Causin ◽  
Bing-Xing Yang ◽  
Carla Marega ◽  
Suat Hong Goh ◽  
Antonio Marigo
Keyword(s):  
Carbon Nanotubes ◽  
Structure Property ◽  
Property Relationship ◽  
Structure Property Relationship ◽  
Multi Walled Carbon Nanotubes ◽  
Walled Carbon Nanotubes

Influence of Surface Oxides on the Colloidal Stability of Multi-Walled Carbon Nanotubes: A Structure−Property Relationship

Langmuir ◽  
2009 ◽  
Vol 25 (17) ◽  
pp. 9767-9776 ◽  
Author(s):  
Billy Smith ◽  
Kevin Wepasnick ◽  
Kaitlin E. Schrote ◽  
Hyun-Hee Cho ◽  
William P. Ball ◽  
...  
Keyword(s):  
Carbon Nanotubes ◽  
Colloidal Stability ◽  
Structure Property ◽  
Property Relationship ◽  
Surface Oxides ◽  
Structure Property Relationship ◽  
Multi Walled Carbon Nanotubes ◽  
Walled Carbon Nanotubes

Predictive quantitative structure–property relationship (QSPR) modeling for adsorption of organic pollutants by carbon nanotubes (CNTs)

2019 ◽  
Vol 6 (1) ◽  
pp. 224-247 ◽  
Author(s):  
Joyita Roy ◽  
Sulekha Ghosh ◽  
Probir Kumar Ojha ◽  
Kunal Roy
Keyword(s):  
Carbon Nanotubes ◽  
Organic Pollutants ◽  
Quantitative Structure ◽  
Structure Property ◽  
Quantitative Structure Property Relationship ◽  
Property Relationship ◽  
Structure Property Relationship ◽  
Qspr Modeling ◽  
New Generation ◽  
Inorganic And Organic

Nanotechnology has introduced a new generation of adsorbents like carbon nanotubes (CNTs), which have drawn a widespread attention due to their outstanding ability for the removal of various inorganic and organic pollutants.

Structure–property relationships in thermally-annealed multi-walled carbon nanotubes

Carbon ◽  
2014 ◽  
Vol 66 ◽  
pp. 219-226 ◽  
Author(s):  
Go Yamamoto ◽  
Keiichi Shirasu ◽  
Yo Nozaka ◽  
Yoshinori Sato ◽  
Toshiyuki Takagi ◽  
...  
Keyword(s):  
Carbon Nanotubes ◽  
Structure Property ◽  
Structure Property Relationships ◽  
Multi Walled Carbon Nanotubes ◽  
Walled Carbon Nanotubes

Structure-property relationships in polyamide 6/multi-walled carbon nanotubes nanocomposites

2009 ◽  
Vol 47 (8) ◽  
pp. 764-774 ◽  
Author(s):  
Emmanuel Logakis ◽  
Christos Pandis ◽  
Vasilios Peoglos ◽  
Polycarpos Pissis ◽  
Charalampos Stergiou ◽  
...  
Keyword(s):  
Carbon Nanotubes ◽  
Polyamide 6 ◽  
Structure Property ◽  
Structure Property Relationships ◽  
Multi Walled Carbon Nanotubes ◽  
Walled Carbon Nanotubes

scholarly journals Proton transfer reaction confined within carbon nanotubes: Density functional theory and quantitative structure–property relationship analysis

2019 ◽  
Vol 45 ◽  
pp. 146867831986447
Author(s):  
Bilal Achouri ◽  
Yamina Belmiloud ◽  
Meziane Brahimi
Keyword(s):  
Carbon Nanotubes ◽  
Density Functional Theory ◽  
Proton Transfer ◽  
Density Functional ◽  
Quantitative Structure ◽  
Structure Property ◽  
Functional Theory ◽  
Quantitative Structure Property Relationship ◽  
Property Relationship ◽  
Structure Property Relationship

In this work, we focus our attention on chemical reactions confined within carbon nanotubes. As a result of the confinement within carbon nanotubes, novel physical and chemical properties are found for the confined materials. We consider the feasibility of proton transfer inside carbon nanotubes. To do that, we have chosen formamide as the simplest real model for exhibiting the tautomerization in DNA. We have used the quantitative structure–property relationship method, based on geometry optimization and quantum chemical structural descriptors, to illustrate the potential of using the confined space inside carbon nanotubes, which will provide comprehensive information about carbon nanotubes. All calculations have been carried out using density functional theory quantum calculations with the B3LYP functional. The geometries optimized by the Gaussian program were transferred to the computer software DRAGON to calculate pertinent descriptors that could be used in the quantitative structure–property relationship model.

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