Title of article
Archimedene
Author/Authors
Schulman، نويسنده , , Jerome M. and Disch، نويسنده , , Raymond L.، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 1996
Pages
4
From page
813
To page
816
Abstract
The geometry and energetics of archimedene, a C120 fullerene, are studied at the HF/STO-3G and AM1 levels. Both methods produce a structure of Ih symmetry containing 12 decagons, 30 rectangles and 20 hexagons. The latter are cyclohexatriene-like benzene rings. The 1Ag closed-shell electronic state has a HOMO-LUMO gap similar to those found in other fullerenes, such as C60 and C70.
Journal title
Chemical Physics Letters
Serial Year
1996
Journal title
Chemical Physics Letters
Record number
1771830
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