Gas phase thermodynamic properties of PBDEs, PBBs, PBPs, HBCD and TBBPA predicted using DFT method

Journal of Molecular Structure: THEOCHEM

Volumn 822, Issue 1-3, 2007, Pages 38-44

  Grabda, Mariusz ^a,b   Oleszek Kudlak, Sylwia ^a,b   Shibata, Etsuro ^a   Nakamura, Takashi ^a  

^a TOHOKU UNIVERSITY   (Japan)

^b INSTITUTE OF ENVIRONMENTAL ENGINEERING   (Poland)

Author keywords

BFRs; DFT; Gaussian; Thermodynamic properties

Indexed keywords

EID: 34848829245     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2007.07.013     Document Type: Article

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