A theoretical study on certain C-58 species

Turker, L

doi:10.1016/s0166-1280(01)00573-5

A theoretical study on certain C-58 species

Atıf İçin Kopyala

Turker L.

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, cilt.571, ss.99-102, 2001 (SCI-Expanded)

Yayın Türü: Makale / Tam Makale
Cilt numarası: 571
Basım Tarihi: 2001
Doi Numarası: 10.1016/s0166-1280(01)00573-5
Dergi Adı: JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
Derginin Tarandığı İndeksler: Science Citation Index Expanded (SCI-EXPANDED), Scopus
Sayfa Sayıları: ss.99-102
Orta Doğu Teknik Üniversitesi Adresli: Hayır

Özet

Various electronic states of C-58 structure which is theoretically obtained from C-60 molecule by removing a C-2 unit and deleting a C-C bond shared by two adjacent hexagons have been considered for AM1 (UHF) type semiempirical molecular orbital calculations. (C) 2001 Elsevier Science B.V. All rights reserved.