I. E. Kareev, V. P. Bubnov, A. I. Kotov, B. V. Lobanov, A. I. Murzashev, I. A. Rumyantsev, “Energy spectrum of isomer no. 3 of C$_{82}$ fullerene of $C_2$ symmetry”, Fizika Tverdogo Tela, 2017, Volume 59, Issue 1,Pages 200

This article is cited in 2 papers

Fullerenes

Energy spectrum of isomer no. 3 of C$_{82}$ fullerene of $C_2$ symmetry

I. E. Kareev^a, V. P. Bubnov^a, A. I. Kotov^a, B. V. Lobanov^b, A. I. Murzashev^b, I. A. Rumyantsev^b

^a Institute of Problems of Chemical Physics, Russian Academy of Sciences, Chernogolovka, Moscow region
^b Mari State University, Ioshkar-Ola

Abstract: The energy spectrum of C$_{82}$ fullerene (isomer no. 3 of $C_2$ symmetry) is calculated within the Hubbard model in the approximation of static fluctuations. Based on the energy spectrum, optical absorption spectra of this isomer in neutral and anionic states with one, two, three, and four additional electrons are simulated. The calculated optical spectra in neutral and monoanionic states are compared with known experimental spectra.

Received: 18.05.2016
Revised: 05.06.2016