Theoretical Investigation of Hydrogen Sulfide Adsorption on the Surface of F Functionalized Carbon and Carbon Silicon Nanotubes (7,0) in the Gas Phase and Water
 
MEYSAM Najafi;

关键词:DFT;water;nanotube;H_2S;functionalizatio
 
主要内容:In order to develop a sensor for the detection of toxic H_2S molecule,the interactions of C–NT and CSi–NT with H_2S mole
 
《结构化学》  2017,36(03):387-395
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