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A theoretical study on the simplest fullerene, C-20 - an AM1 treatment
Date
2003-05-05
Author
Türker, Burhan Lemi
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Within the constraints of AM1 (UHF) type semiempirical quantum chemical treatment, C-20 and its cationic and anionic forms were considered for their stabilities. The results revealed that C-20 has a greater tendency to act as electron acceptor than a donor. C-20(-) and C-20(-2) were found to be even more stable than C-20.
Subject Keywords
Physical and Theoretical Chemistry
,
Biochemistry
,
Condensed Matter Physics
URI
https://hdl.handle.net/11511/62301
Journal
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
DOI
https://doi.org/10.1016/s0166-1280(03)00015-0
Collections
Department of Chemistry, Article
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Türker, Burhan Lemi (Elsevier BV, 2003-11-17)
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B. L. Türker, “A theoretical study on the simplest fullerene, C-20 - an AM1 treatment,”
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
, pp. 169–171, 2003, Accessed: 00, 2020. [Online]. Available: https://hdl.handle.net/11511/62301.