Molecular dynamics simulation of TCDD adsorption on organo-montmorillonite

Journal of Colloid and Interface Science

Volumn 377, Issue 1, 2012, Pages 328-333

  Zhu, Runliang ^a,b   Hu, Wenhao ^a   You, Zhimin ^a   Ge, Fei ^a   Tian, Kaixun ^a  

^a XIANGTAN UNIVERSITY   (China)

^b GUANGZHOU INSTITUTE OF GEOCHEMISTRY   (China)

Author keywords

Adsorption; Hydrophobic organic contaminants; Molecular dynamics simulation; Organo montmorillonite

Indexed keywords

ADSORPTION CAPACITIES; ADSORPTION ENERGIES; ATTRACTIVE FORCE; GALLERY HEIGHT; HYDROPHOBIC ORGANIC CONTAMINANT; INTERLAYER SPACES; MODIFIED MONTMORILLONITE; MOLECULAR DYNAMICS SIMULATIONS; NOVEL INFORMATION; ORGANIC CATIONS; ORGANIC CONTAMINANT; ORGANO-MONTMORILLONITE; ORGANOCLAYS; OUTER SURFACE; SILOXANE SURFACES; TETRACHLORODIBENZO P DIOXINS; TETRAMETHYLAMMONIUM;

CLAY MINERALS; MOLECULAR DYNAMICS; MOLECULAR MECHANICS; POSITIVE IONS; URANATE MINERALS;

ADSORPTION;

CATION; MONTMORILLONITE; ORGANIC COMPOUND; SILOXANE; TETRACHLORODIBENZO 4 DIOXIN; TETRAMETHYLAMMONIUM; TETRAPROPYLAMMONIUM; UNCLASSIFIED DRUG;

ADSORPTION; ARTICLE; CHEMICAL INTERACTION; CHEMICAL STRUCTURE; HYDROPHOBICITY; MOLECULAR DYNAMICS; POLLUTANT; PRIORITY JOURNAL; SIMULATION; SURFACE PROPERTY;

ADSORPTION; BENTONITE; MODELS, MOLECULAR; MOLECULAR DYNAMICS SIMULATION; TETRACHLORODIBENZODIOXIN;

EID: 84860775342     PISSN: 00219797     EISSN: 10957103     Source Type: Journal    
DOI: 10.1016/j.jcis.2012.03.034     Document Type: Article

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