DocumentCode
1887374
Title
Theoretical analysis of C/sub 60/ and its pt-derivative
Author
Kee Hag Lee ; Han Myoung Lee ; Wang Ro Lee
Author_Institution
Wonkwang University
fYear
1994
fDate
24-29 July 1994
Firstpage
189
Lastpage
189
Abstract
Summary form only given. The electronic structures of the C/sub 60/, (H/sub 3/P)/sub 2/Pt(/spl eta//sup 2/-C/sub 2/H/sub 4/) and (H/sub 3/P)/sub 2/Pt(/spl eta//sup 2/-C/sub 60/) are calculated by using the EHT-MO method with the fragment analysis. We have modified the EHT parameters so as to yield the energy level correlation and optical transition gap for the previous theoretical results of C/sub 60/. In Pt-derivatives, our FMO results with the modified parameters show that the carbon-carbon double bonds of C/sub 60/ and ethene react like those of electron-poor arenes and alkenes, and also that C/sub 60/ is more electron-susceptive than C/sub 2/H/sub 4/.
Keywords
Energy states;
fLanguage
English
Publisher
ieee
Conference_Titel
Science and Technology of Synthetic Metals, 1994. ICSM '94. International Conference on
Conference_Location
Seoul, Korea
Type
conf
DOI
10.1109/STSM.1994.834994
Filename
834994
Link To Document