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Linear carbon chains of type Si[C.sub.n]O (n = 3-8): Results of coupled cluster calculations

Authors :
Botschwina, Peter
Source :
Journal of Physical Chemistry A. March 9, 2006, Vol. 110 Issue 9, 3216-3221
Publication Year :
2006

Abstract

Accurate equilibrium bond lengths are established for linear carbon chains of type Si[C.sub.n]O with n = 3-8 on the basis of Results of Coupled Cluster Calculations. It is demonstrated that the ground state rotational constants of Si[C.sub.3]O, Si[C.sub.4]O and Si[C.sub.5]O are predicted with ca. 0.1% accuracy.

Details

Language :
English
ISSN :
10895639
Volume :
110
Issue :
9
Database :
Gale General OneFile
Journal :
Journal of Physical Chemistry A
Publication Type :
Academic Journal
Accession number :
edsgcl.155804954