Authors
Citation
Eeb. Campbell et al., INCREASING COST OF PENTAGON ADJACENCY FOR LARGER FULLERENES, Chemical physics letters, 250(5-6), 1996, pp. 544-548
Citations number
14
Categorie Soggetti
Physics, Atomic, Molecular & Chemical
Journal title
ISSN journal
00092614
Volume
250
Issue
5-6
Year of publication
1996
Pages
544 - 548
Database
ISI
SICI code
0009-2614(1996)250:5-6<544:ICOPAF>2.0.ZU;2-M
Abstract
The cost of a pentagon adjacency in a fullerene cage grows linearly fr
om 72 kJ mol(-1) for C-30 to 111 kJ mol(-1) for C-60, according to sys
tematic QCFF/PI model calculations on a set of 2624 structural isomers
.