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ON THE WAY TO FULLERENES - MOLECULAR-DYNAMICS STUDY OF THE CURLING AND CLOSURE OF GRAPHITIC RIBBONS
Author(s): ROBERTSON DH, BRENNER DW, WHITE CT
Source: JOURNAL OF PHYSICAL CHEMISTRY    Volume: 96    Issue: 15    Pages: 6133-6135    Published: JUL 23 1992  
Times Cited: 86     References: 20     
Abstract: The short-time behavior of isolated graphitic ribbons is simulated at high temperature using a model hydrocarbon potential. These ribbons show large instantaneous deviations from planarity that often result in the formation of open-ended hollow carbon structures representing good fullerene precursors. While confirming the importance of pentagon formation in the production of these precursors, these results also point to the central role of relatively high temperatures in these processes.
Document Type: Letter
Language: English
Reprint Address: ROBERTSON, DH (reprint author), USN, RES LAB, THEORET CHEM SECT, CODE 6179, WASHINGTON, DC 20375 USA
Publisher: AMER CHEMICAL SOC, 1155 16TH ST, NW, WASHINGTON, DC 20036
Subject Category: Chemistry, Physical
IDS Number: JF326
ISSN: 0022-3654
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