The effect of electric field on interaction of glycine with (6,0) single-walled boron nitride nanotube

The interaction between glycine molecule with (6, 0) zigzag model of single-walled boron nitride nanotube (BNNT) with H-terminated at the open ended, has been investigated in the presence and absence of the external electric field (EF), using the DFT-B3LYP/6-31G

Bibliographic Details
Main Authors: Farmanzadeh Davood, Ghazanfary Samereh
Format: Article
Language:English
Published: Serbian Chemical Society 2013-01-01
Series:Journal of the Serbian Chemical Society
Subjects:
Online Access:http://www.doiserbia.nb.rs/img/doi/0352-5139/2013/0352-51391200046F.pdf
Description
Summary:The interaction between glycine molecule with (6, 0) zigzag model of single-walled boron nitride nanotube (BNNT) with H-terminated at the open ended, has been investigated in the presence and absence of the external electric field (EF), using the DFT-B3LYP/6-31G
ISSN:0352-5139