Email this article Optical Absorption Spectrum of Metal–Nitride Complexes of С80 Fullerene as Strongly Correlated Systems
- Authors: Lobanov B.V.1,2, Murzashev A.I.1,2, Melnikova N.V.2
-
Affiliations:
- Mari State University
- National Research Tomsk State University
- Issue: Vol 61, No 12 (2019)
- Pages: 2288-2292
- Section: Article
- URL: https://journals.rcsi.science/1064-8887/article/view/241378
- DOI: https://doi.org/10.1007/s11182-019-01669-0
- ID: 241378
Cite item
Open Access
Access granted
Subscription Access
Abstract
Within the framework of Hubbard’s model using an approximation of static fluctuations, the energy spectrum of the π-electron subsystem of an icosahedral C80 fullerene isomer is obtained. Based on the energy spectrum, an optical absorption spectrum of metal-nitride complexes M3N@C80 (M = Gd, Tm, Dy) is simulated. It is quite consistent with the respective experimental spectrum.
Keywords
About the authors
B. V. Lobanov
Mari State University; National Research Tomsk State University
Author for correspondence.
Email: lbv_marsu@mail.ru
Russian Federation, Yoshkar-Ola; Tomsk
A. I. Murzashev
Mari State University; National Research Tomsk State University
Email: lbv_marsu@mail.ru
Russian Federation, Yoshkar-Ola; Tomsk
N. V. Melnikova
National Research Tomsk State University
Email: lbv_marsu@mail.ru
Russian Federation, Tomsk
Supplementary files
