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Theoretical studies on the potentials of some nanocages (Al 12 N 12 , Al 12 P 12 , B 12 N 12 , Be 12 O 12 , C 12 Si 12 , Mg 12 O 12 and C 24 ) on the detection and adsorption of Tabun molecule: DFT and TD-DFT study

Theoretical studies on the potentials of some nanocages (Al 12 N 12 , Al 12 P 12 , B 12 N 12 , Be 12 O 12 , C 12 Si 12 , Mg 12 O 12 and C 24 ) on the detection and adsorption of Tabun molecule: DFT and TD-DFT study

Fallahi, Paria; Jouypazadeh, Hamidreza; Farrokhpour, Hossein

期刊名称Journal of Molecular Liquids
作者Fallahi, Paria; Jouypazadeh, Hamidreza; Farrokhpour, Hossein
印刷ISSN0167-7322
文件大小1832.17KB
发表时间2018-3
DOI10.1016/j.molliq.2018.03.085

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