Molecular modeling of interactions between heavy crude oil and the soil organic matter coated quartz surface

Chemosphere

Volumn 119, Issue , 2015, Pages 242-249

  Wu, Guozhong ^a   Zhu, Xinzhe ^a   Ji, Haoqing ^a   Chen, Daoyi ^a  

^a TSINGHUA UNIVERSITY   (China)

Author keywords

Fulvic acid; Heavy crude oil; Humic acid; Molecular dynamic simulation; Quartz; Soil organic matter

Indexed keywords

ADSORPTION; AGGLOMERATION; ASPHALTENES; BIOGEOCHEMISTRY; MOLECULAR DYNAMICS; ORGANIC ACIDS; QUARTZ; RESINS; SOILS;

ENVIRONMENTAL RISKS; FULVIC ACIDS; HEAVY CRUDE OIL; HUMIC ACID; OIL ADSORPTION CAPACITIES; SOIL HUMIC ACIDS; SOIL ORGANIC MATTERS; SUWANNEE RIVER FULVIC ACID;

CRUDE OIL;

FULVIC ACID; HUMIC ACID; PETROLEUM; RESIN; SOIL ORGANIC MATTER; BENZOPYRAN DERIVATIVE; HUMIC SUBSTANCE; SILICON DIOXIDE; SOIL; SOIL POLLUTANT;

ADSORPTION; ASPHALTENE; BIOAVAILABILITY; CRUDE OIL; ENVIRONMENTAL RISK; INTERFACE; MOBILITY; MOLECULAR ANALYSIS; QUARTZ; RESIN; SIMULATION; SOIL AGGREGATE; SOIL ORGANIC MATTER; SOIL REMEDIATION;

ARTICLE; BIOAVAILABILITY; DIFFUSION COEFFICIENT; ELASTICITY; MOLECULAR DYNAMICS; MOLECULAR INTERACTION; MOLECULAR MODEL; SANDY SOIL; SURFACE PROPERTY; VALIDATION STUDY; ADSORPTION; CHEMISTRY; DIFFUSION; HUMIC SUBSTANCE; SOIL; SOIL POLLUTANT;

ADSORPTION; BENZOPYRANS; DIFFUSION; HUMIC SUBSTANCES; MOLECULAR DYNAMICS SIMULATION; PETROLEUM; QUARTZ; SOIL; SOIL POLLUTANTS;

EID: 84919709984     PISSN: 00456535     EISSN: 18791298     Source Type: Journal    
DOI: 10.1016/j.chemosphere.2014.06.030     Document Type: Article

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