A theoretical study on certain C-58 species


Turker L.

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, vol.571, pp.99-102, 2001 (Journal Indexed in SCI) identifier identifier

  • Publication Type: Article / Article
  • Volume: 571
  • Publication Date: 2001
  • Doi Number: 10.1016/s0166-1280(01)00573-5
  • Title of Journal : JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
  • Page Numbers: pp.99-102

Abstract

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.