Sorption and Diffusion of Water Vapor and Carbon Dioxide in Sulfonated Polyaniline as Chemical Sensing Materials

Sorption and Diffusion of Water Vapor and Carbon Dioxide in Sulfonated Polyaniline as Chemical Sensing Materials

A hybrid quantum mechanics (QM)/molecular dynamics (MD) simulation is performed to investigate the effect of an ionizable group (–SO3−Na+) on polyaniline as gas sensing materials. Polymers considered for this work include emeraldine base of polyaniline (EB-PANI) and its derivatives (Na-SPANI (I), (I...

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Bibliographic Details
Main Authors: Qiuhua Liang, Junke Jiang, Huaiyu Ye, Ning Yang, Miao Cai, Jing Xiao, Xianping Chen
Format: Article
Language:English
Published: MDPI AG 2016-04-01
Series:Sensors
Subjects:
polyaniline
sensitivity
adsorption
diffusion
gas sensors
Online Access:http://www.mdpi.com/1424-8220/16/5/606

Internet

http://www.mdpi.com/1424-8220/16/5/606

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