Molecular dynamics simulations on the interactions of low molecular weight natural organic acids with C60

Chemosphere

Volumn 92, Issue 4, 2013, Pages 429-434

  Sun, Qian ^a,b   Xie, Hong Bin ^b   Chen, Jingwen ^b   Li, Xuehua ^b   Wang, Zhuang ^b   Sheng, Lianxi ^a  

^a NORTHEAST NORMAL UNIVERSITY   (China)

^b DALIAN UNIVERSITY OF TECHNOLOGY   (China)

Author keywords

Interaction; Low molecular weight organic acids; Molecular dynamics

Indexed keywords

CARBON; HYDROPHOBICITY; MOLECULAR WEIGHT; NANOSTRUCTURED MATERIALS; ORGANIC ACIDS;

AQUATIC ENVIRONMENTS; CARBON NANO-MATERIALS; DISSOLVED ORGANIC MATTERS; ENVIRONMENTAL IMPLICATIONS; HYDROPHOBIC INTERACTIONS; INTERACTION; LOW MOLECULAR WEIGHT ORGANIC ACID; MOLECULAR DYNAMICS SIMULATIONS;

MOLECULAR DYNAMICS;

AROMATIC CARBOXYLIC ACID; CARBOXYLIC ACID; DISSOLVED ORGANIC MATTER; FULLERENE; LOW MOLECULAR WEIGHT ORGANIC ACID; NANOMATERIAL; UNCLASSIFIED DRUG; WATER;

ADSORPTION; AQUATIC ECOSYSTEM; COST-BENEFIT ANALYSIS; DISSOLVED ORGANIC MATTER; HYDROPHOBICITY; MOLECULAR ANALYSIS; NUMERICAL MODEL; ORGANIC ACID; SIMULATION;

ADSORPTION; AQUATIC ENVIRONMENT; ARTICLE; ATMOSPHERIC DISPERSION; HYDROPHOBICITY; MOLECULAR DYNAMICS; MOLECULAR INTERACTION; MOLECULAR WEIGHT; PREDICTIVE VALUE; TROPOSPHERE; VACUUM;

EID: 84878110777     PISSN: 00456535     EISSN: 18791298     Source Type: Journal    
DOI: 10.1016/j.chemosphere.2013.01.039     Document Type: Article

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