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Combination bands of small linear carbon clusters: an infrared isotopic study

✍ Scribed by Jason F. Fuller; Jan Szczepanski; Martin Vala

Book ID: 108311935
Publisher: Elsevier Science
Year: 2000
Tongue: English
Weight: 156 KB
Volume: 323
Category: Article
ISSN: 0009-2614
DOI: 10.1016/s0009-2614(00)00515-7

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## Abstract Theoretical studies on BC~__n__~ (__n__=1–6) clusters are carried out using density functional theory, Møller–Plesset second‐order perturbation theory (MP2), coupled‐cluster calculations including up to triple excitations (CCSD(T)), and higher‐level approaches. All possible isomers depe