Title of article
Elementary processes in pressure-induced polymerization of C60
Author/Authors
Ozaki، نويسنده , , T and Iwasa، نويسنده , , Y and Mitani، نويسنده , , T، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 1998
Pages
5
From page
289
To page
293
Abstract
Pressure-induced polymerization in crystalline C60 has been investigated theoretically within a semi-empirical quantum chemical method. The model calculations reveal that distortion of the C60 molecules plays an essential role in the pressure-induced polymerization. The drastic difference in experimental conditions for the polymerization and the depolymerization are reasonably explained from the model calculation.
Journal title
Chemical Physics Letters
Serial Year
1998
Journal title
Chemical Physics Letters
Record number
1772644
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