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Ab Initio investigation of the electronic structure and stabilities of triatomic helide ions: He2Xn+ clusters (where X=B–Ne, Al–Ar and n=1–2)

✍ Scribed by Jason M. Hughes; Ellak I. von Nagy-Felsobuki


Book ID
114143166
Publisher
Elsevier Science
Year
1999
Tongue
English
Weight
190 KB
Volume
459
Category
Article
ISSN
0166-1280

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## Abstract __Ab initio__ calculations of structural stability and properties of selected IIIa–Va monomers (BN, BP, AlN, AlP), and dimers and trimers thereof are presented. It was demonstrated that multireference methods are needed for an appropriate description of the electronic structure of the d