Effect Of Strain on Optical Conductivity in Monolayer FeCl2

Autor:	T B Prayitno, E Budi, B Nuryasin, M A Abdillah, M C Kartika
Rok vydání:	2022
Předmět:	History Computer Science Applications Education
Zdroj:	Journal of Physics: Conference Series. 2377:012022
ISSN:	1742-6596 1742-6588
DOI:	10.1088/1742-6596/2377/1/012022
Popis:	We implemented the density functional theory to study the effect of strain on the optical conductivity in 1T monolayer FeCl2 within the collinear structure. The computational calculation was run based on the Kubo-Greenwood formulation. We showed that the peak of optical conductivity would be shifted by applying strain. This indicates that the optical conductivity is sensitive to the strain. Moreover, we also found that the half-metallicity in the band dispersion disappeared as the lattice parameter was compressed so highly.
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::e7f8aa9313d25353c2d81d3aecb14258 https://doi.org/10.1088/1742-6596/2377/1/012022 Zobrazit plný text záznamu