Zobrazeno 1 - 5
of 5
pro vyhledávání: '"Norredine Marbouh"'
Publikováno v:
International Journal of Hydrogen Energy. 45:33466-33477
In order to first principle density functional theory, the effects of anionic changes on the opto-electronic characteristics and photo-catalyst efficiency of perovskite LiPb(Cl,Br,I)3 is determined for water splitting. In recent years, photo-catalyti
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::466a5cda439caee9639052ec179bc635
https://doi.org/10.1016/j.ijhydene.2020.09.066
https://doi.org/10.1016/j.ijhydene.2020.09.066
Akademický článek
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Publikováno v:
Computational Condensed Matter. 29:e00594
The first principles analysis of structural, elastic, electronic and thermoelectric properties of Calcium Iridium perovskite CaIrO3 compound have been reported. We made our calculations within the full-potential linearized augmented plane wave (FP-LA
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::20d3b5418581aabdaa6b73aafcba1c8a
https://doi.org/10.1016/j.cocom.2021.e00594
https://doi.org/10.1016/j.cocom.2021.e00594
Publikováno v:
Computational Condensed Matter. 23:e00456
We investigate the structural, electronic, magnetic and elastic properties of KMgO3, by using first principle calculations, applying the full-potential linearized augmented plane waves (FP-LAPW) method based totally on functional density theory (DFT)
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::22f69833458448efc43696820501bcc2
https://doi.org/10.1016/j.cocom.2020.e00456
https://doi.org/10.1016/j.cocom.2020.e00456
Autor:
Keltouma Boudia, Yamina Si Abderrahmane, Norredine Marbouh, H. Boutaleb, K. Amara, Friha Khelfaoui, M. Hamlat
Publikováno v:
Computational Condensed Matter. 21:e00399
This study reports on the structural, mechanical and magneto-electronic properties for new perovskite compound LiBeO3. In this paper, the Full Potential Linearized Augmented Plane Wave method is used to investigate these properties. The structural op
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::b02b2038f3474dc287ea95046f6cdb61
https://doi.org/10.1016/j.cocom.2019.e00399
https://doi.org/10.1016/j.cocom.2019.e00399