First-Principle Calculation of Structural, Mechanical, Electronic and Magnetic Properties of Cobalt Sub Hydrides Co2H and Co3H

Autor: Riane Rabah, Merabet N, Abdiche A

Publikováno v: Journal of Material Science & Engineering.

In this present work, we perform first-principles calculations of the structural, electronic, mechanical and mechanical properties of Cobalt sub-hydrides (Co2H and Co3H) based on the density functional theory with local spin density (LSDA), and gener

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::129a124000329655b35075ac06edf6d9
https://doi.org/10.4172/2169-0022.1000463

Ab initio calculations of electronic band structure and charge densities of zinc blende-type GaN, BN and their solid solution B0.5Ga0.5N

Autor: RIANE, Rabah, MATAR, Samir F., HAMMERELAINE, Lahcene

Publikováno v: Zeitschrift fur Naturforschung B
Zeitschrift fur Naturforschung B, Verlag der Zeitschrift Fuer Naturforschung, 2008, 63 (10), pp.1231-1237

International audience; First principles calculations of the electronic band structures of zinc blende-type GaN and BN and their 1 : 1 mixture B0.5Ga0.5N were carried out within DFT using the augmented plane wave method with both GGA and LDA approxim

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=dedup_wf_001::ff9e9de21047592a170f0712a02b802f
https://hal.archives-ouvertes.fr/hal-00338360

ChemInform Abstract: Ab initio Calculations of Electronic Band Structure and Charge Densities of Zinc Blende-Type GaN, BN and Their Solid Solution B0.5Ga0.5N.

Autor: Riane, Rabah, Matar, Samir F., Hammerelaine, Lahcene

Publikováno v: ChemInform; Dec2008, Vol. 39 Issue 51, pno-no, 1p