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Molecular wheel to monocyclic ring transition in boron-carbon mixed clusters C2B6⁻ and C3B5⁻.

Authors :
Galeev TR
Ivanov AS
Romanescu C
Li WL
Bozhenko KV
Wang LS
Boldyrev AI
Source :
Physical chemistry chemical physics : PCCP [Phys Chem Chem Phys] 2011 May 21; Vol. 13 (19), pp. 8805-10. Date of Electronic Publication: 2011 Apr 12.
Publication Year :
2011

Abstract

In this joint experimental and theoretical work we present a novel type of structural transition occurring in the series of C(x)B(8-x)(-) (x=1-8) mixed clusters upon increase of the carbon content from x=2 to x=3. The wheel to ring transition is surprising because it is rather planar-to-linear type of transition to be expected in the series since B(8), B(8)(-), B(8)(2-) and CB(7)(-) are known to possess wheel-type global minimum structures while C(8) is linear.<br /> (© The Owner Societies 2011)

Details

Language :
English
ISSN :
1463-9084
Volume :
13
Issue :
19
Database :
MEDLINE
Journal :
Physical chemistry chemical physics : PCCP
Publication Type :
Academic Journal
Accession number :
21487619
Full Text :
https://doi.org/10.1039/c1cp20359b