The strong dimer of Ge-60, Ge-116

Turker, L

doi:10.1016/j.theochem.2003.11.017

The strong dimer of Ge-60, Ge-116

Atıf İçin Kopyala

Turker L.

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, cilt.672, ss.165-168, 2004 (SCI-Expanded)

Yayın Türü: Makale / Tam Makale
Cilt numarası: 672
Basım Tarihi: 2004
Doi Numarası: 10.1016/j.theochem.2003.11.017
Dergi Adı: JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
Derginin Tarandığı İndeksler: Science Citation Index Expanded (SCI-EXPANDED), Scopus
Sayfa Sayıları: ss.165-168
Orta Doğu Teknik Üniversitesi Adresli: Hayır

Özet

The strong dimer of Ge-60, Ge-116, is considered for MNDOd and AM1 type semiempirical quantum chemical calculations within the limitations of restricted Hartree-Fock formalism. Both methods predict this, yet non-existent, structure to be stable but highly endothermic. Some geometrical and quantum chemical data are presented. (C) 2003 Elsevier B.V. All rights reserved.