Theoretical studies on the structures and energetics of C122H4 isomers

Hidekazu Shimotani, Nita Dragoe, Koichi Kitazawa

研究成果: Article査読

1 被引用数 (Scopus)

抄録

The structure of a previously reported [60]fullerene dimer, C122H4, was analysed by theoretical methods. The predicted 13C NMR spectra of five possible structures of C122H4 were compared with the experimental spectrum. Energetic analysis showed that the relative stabilities of the isomers are most likely dominated by π-electron energies of the corresponding monomer C60H4.

本文言語English
ページ(範囲)428-431
ページ数4
ジャーナルPhysical Chemistry Chemical Physics
4
3
DOI
出版ステータスPublished - 2002 2 11
外部発表はい

ASJC Scopus subject areas

  • 物理学および天文学(全般)
  • 物理化学および理論化学

フィンガープリント

「Theoretical studies on the structures and energetics of C<sub>122</sub>H<sub>4</sub> isomers」の研究トピックを掘り下げます。これらがまとまってユニークなフィンガープリントを構成します。

引用スタイル