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Journal of Molecular Modeling

Volumn 19, Issue 6, 2013, Pages 2197-2203

Sensing behavior of Al-rich AlN nanotube toward hydrogen cyanide

(3) Beheshtian, Javad a Peyghan, Ali Ahmadi b Bagheri, Zargham b

a SHAHID RAJAEE TEACHER TRAINING UNIVERSITY (Iran)

b ISLAMIC AZAD UNIVERSITY (Iran)

Author keywords

B3LYP; DFT; Nanotube; Sensor; Theoretical study

Indexed keywords

ALUMINUM; ALUMINUM RICH ALUMINIUM NITRIDE NANOTUBE; CARBON; HYDROGEN CYANIDE; NANOTUBE; NITROGEN; UNCLASSIFIED DRUG;

ADSORPTION; ARTICLE; CONDUCTANCE; DENSITY FUNCTIONAL THEORY; ELECTRONICS; GEOMETRY; MOLECULAR INTERACTION; PRIORITY JOURNAL;

ADSORPTION; ALUMINUM COMPOUNDS; COMPUTER SIMULATION; HYDROGEN CYANIDE; MODELS, CHEMICAL; MOLECULAR STRUCTURE; NANOTUBES;

EID: 84878755424 PISSN: 16102940 EISSN: 09485023 Source Type: Journal
DOI: 10.1007/s00894-012-1751-2 Document Type: Article

Times cited : (64)

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