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Structural and electronic properties of PFOS and LiPFOS
Date
2001-08-13
Author
Erkoç, Şakir
Erkoc, F
Metadata
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The structural and electronic properties of perfluorinated surfactants perfluorooctane sulfonate (PFOS) and lithium perfluorooctane sulfonate (LiPFOS) have been investigated theoretically by performing semi-empirical molecular orbital theory at the level of AM I calculations. The optimized structure and the electronic properties of the molecules are obtained. (C) 2001 Elsevier Science BN. All rights reserved.
Subject Keywords
AM1 method
,
PFOS
,
LiPFOS
URI
https://hdl.handle.net/11511/51126
Journal
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
DOI
https://doi.org/10.1016/s0166-1280(01)00553-x
Collections
Department of Physics, Article
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Ş. Erkoç and F. Erkoc, “Structural and electronic properties of PFOS and LiPFOS,”
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
, pp. 289–293, 2001, Accessed: 00, 2020. [Online]. Available: https://hdl.handle.net/11511/51126.