THEORETICAL STUDY OF CARBONYL SULFIDE ADSORPTION ON AG-DOPED SIC NANOTUBES

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AHMADI PEYGHAN ALI; SOLEYMANABADI HAMED; Bagheri Zargham

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Journal Paper

Paper Information

Journal: JOURNAL OF THE IRANIAN CHEMICAL SOCIETY(JICS) Year:2015 | Volume:12 | Issue:6 Page(s): 1071-1076

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Information Journal Paper

Title

THEORETICAL STUDY OF CARBONYL SULFIDE ADSORPTION ON AG-DOPED SIC NANOTUBES

Author(s)

AHMADI PEYGHAN ALI | SOLEYMANABADI HAMED | Bagheri Zargham

Keywords

NANOTUBES

SENSOR

DFT

THEORETICAL STUDY

Abstract

We have investigated the interaction of a COS molecule with a SiC nanotube by means of density functional theory calculations. A carbon or silicon atom of the tube was replaced by an Ag atom, exploring its effect on the interaction. Replacing a carbon and a silicon atom by an Ag atom increases and decreases the adsorption energy, respectively. We found that the carbon doping by Ag atom makes the nanotube a potential chemical SENSOR to the gaseous COS molecules.

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APA: Copy

AHMADI PEYGHAN, ALI, SOLEYMANABADI, HAMED, & Bagheri, Zargham. (2015). THEORETICAL STUDY OF CARBONYL SULFIDE ADSORPTION ON AG-DOPED SIC NANOTUBES. JOURNAL OF THE IRANIAN CHEMICAL SOCIETY(JICS), 12(6), 1071-1076. SID. https://sid.ir/paper/283099/en

Vancouver: Copy

AHMADI PEYGHAN ALI, SOLEYMANABADI HAMED, Bagheri Zargham. THEORETICAL STUDY OF CARBONYL SULFIDE ADSORPTION ON AG-DOPED SIC NANOTUBES. JOURNAL OF THE IRANIAN CHEMICAL SOCIETY(JICS)[Internet]. 2015;12(6):1071-1076. Available from: https://sid.ir/paper/283099/en

IEEE: Copy

ALI AHMADI PEYGHAN, HAMED SOLEYMANABADI, and Zargham Bagheri, “THEORETICAL STUDY OF CARBONYL SULFIDE ADSORPTION ON AG-DOPED SIC NANOTUBES,” JOURNAL OF THE IRANIAN CHEMICAL SOCIETY(JICS), vol. 12, no. 6, pp. 1071–1076, 2015, [Online]. Available: https://sid.ir/paper/283099/en

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