CALCULATED ELECTRONIC AND OPTICAL-PROPERTIES OF A GRAPHITE-INTERCALATION COMPOUND - LIC6

Citation
R. Ahuja et al., CALCULATED ELECTRONIC AND OPTICAL-PROPERTIES OF A GRAPHITE-INTERCALATION COMPOUND - LIC6, Journal of physics. Condensed matter, 9(45), 1997, pp. 9845-9852
Citations number
35
Categorie Soggetti
Physics, Condensed Matter
ISSN journal
09538984
Volume
9
Issue
45
Year of publication
1997
Pages
9845 - 9852
Database
ISI
SICI code
0953-8984(1997)9:45<9845:CEAOOA>2.0.ZU;2-0
Abstract
We have used the linear muffin-tin orbital method, without geometrical approximations, to calculate the electronic structure of LiC6. Using our self-consistent solution, we have calculated the anisotropic frequ ency-dependent dielectric function and the reflectivity spectrum. The calculated reflectivity spectrum is in good agreement with the experim ental data.