Please use this identifier to cite or link to this item: https://dspace.ctu.edu.vn/jspui/handle/123456789/33388
Title: Chemical bonding in trimers of Ge₂ with monovalent metals
Authors: Tran, Tuong Son
Vo, Ngoc Tu
Vo, Thi Thu Thanh
Vu, Thi Ngan
Keywords: Monovalent metal doped germanium cluster
Chemical bonding
Density functional theory study
NBO
B3P86
Issue Date: 2020
Series/Report no.: Vietnam Journal of Chemistry;Vol. 58 No. 02 .- P.162-167
Abstract: Chemical bonding of the monovalent metal-doped germanium Ge₂M (M belonging the groups IA and IB) clusters is investigated by using quantum Chemical calculations combined with the analyses of natural atomic orbital (NAO), natural bond orbital (NBO) and natural resonance theory (NRT). All of the clusters have a ground State in isosceles triangle shape with two quasi-degenerate electronic States (²A₁, ²B₁).
URI: https://dspace.ctu.edu.vn/jspui/handle/123456789/33388
ISSN: 2525-2321
Appears in Collections:Vietnam Journal of Chemistry

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