ELECTRONIC-ENERGY CALCULATION OF C-60 CLUSTERS

KATIRCIOGLU S., ERKOC S., HALICIOGLU T.

MATERIALS CHEMISTRY AND PHYSICS, cilt.34, sa.1, ss.78-80, 1993 (SCI-Expanded) identifier identifier

  • Yayın Türü: Makale / Tam Makale
  • Cilt numarası: 34 Sayı: 1
  • Basım Tarihi: 1993
  • Doi Numarası: 10.1016/0254-0584(93)90124-5
  • Dergi Adı: MATERIALS CHEMISTRY AND PHYSICS
  • Derginin Tarandığı İndeksler: Science Citation Index Expanded (SCI-EXPANDED), Scopus
  • Sayfa Sayıları: ss.78-80
  • Orta Doğu Teknik Üniversitesi Adresli: Evet

Özet

The ground-state total electronic energy of the Buckminsterfullerene (BF) and truncated dodecahedron (TD) models of C60 has been calculated using the empirical tight-binding (ETB) method. it was found that the BF model was energetically more stable than the TD model Of C60.