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Theoretical study on hydrophilicity and thermodynamic properties of polyfluorinated dibenzofurans |
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| Authors: | Shi Jiaqi Liu Hongxia Sun Li Hou Haifeng Xu Ying Wang Zunyao |
| Institution: | a State Key Laboratory of Pollution Control and Resources Reuse, School of Environment, Nanjing University, Jiangsu, Nanjing 210046, PR China b Department of Biological and Chemical Engineering, Jiaxing University, Jiaxing 314001, Zhejiang, PR China c Department of Environmental and Safety Engineering, Changzhou University, Changzhou 213164, Jiangsu, PR China |
| Abstract: | |
| Keywords: | Polyfluorinated dibenzofurans Octanol-water partition coefficient (Kow) Thermodynamic property Density functional theory The number and position of fluorine atom substitution Relative stability |
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