Molecular simulation of polycyclic aromatic hydrocarbon sorption to black carbon
نویسندگان
چکیده
منابع مشابه
Molecular simulation of polycyclic aromatic hydrocarbon sorption to black carbon.
Strong sorption of hydrophobic organic contaminants to soot or black carbon (BC) is an important environmental process limiting the bioremediation potential of contaminated soils and sediments. Reliable methods to predict BC sorption coefficients for organic contaminants are therefore required. A computer simulation based on molecular mechanics using force field methods has been applied in this...
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ژورنال
عنوان ژورنال: SAR and QSAR in Environmental Research
سال: 2009
ISSN: 1062-936X,1029-046X
DOI: 10.1080/10629360902949336