Theoretical study of structural and electronic properties of poly(vinyl chloride) nanotube inclusions

Theoretical study of structural and electronic properties of poly(vinyl chloride) nanotube inclusions

<div>The structural and electronic properties of inclusion or interconnection between NT and PVC were studied by quantum semiepirical approximation method using (PM3) self-consistent ?eld molecular orbital method. The total structural energy, HOMO level energy, LUMO level energy, band...

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Bibliographic Details
Main Author: Assad Kareen Edaan
Format: Article
Language:English
Published: Universidade Federal de Mato Grosso do Sul 2012-10-01
Series:Orbital: The Electronic Journal of Chemistry
Subjects:
nanotube
pvc
pm3
homo
lumo
dipole moment
Online Access:http://orbital.ufms.br/index.php/Chemistry/article/view/321

Internet

http://orbital.ufms.br/index.php/Chemistry/article/view/321

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