Search Results - "Blaha, L. F."

Investigation of the Structural, Elastic, Electronic, and Optical Properties of Half-Heusler CaMgZ (Z = C, Si, Ge, Sn, Pb) Compounds by Saim, A., Belkharroubi, F., Boufadi, F. Z., Ameri, I., Blaha, L. F., Tebboune, A., Belkaid, M. N., Belkilali, W., Ameri, M., Al-Douri, Y., Abd El-Rehim, A. F.

“…The structural, elastic, electronic, and optical properties of half-Heusler CaMgZ (Z = C, Si, Ge, Sn, Pb) compounds are investigated herein. Density functional…”
Get full text

Electronic properties, stability and thermoelectric response of CoFeZrZ (Z= Ge, Sb) quaternary Heuslers by Maafa, A., Blaha, L.F., Rozale, H., Ougilas, A., Boukli, M.A.H., Sayade, A.

“…A set of ab-initio calculations have been performed to investigate the structural, electronic and thermoelectric properties, in addition to mechanical…”
Get full text

Adsorption of 2-4-6.trichlorophenol on montmorillonite surface: ONIOM study by Taqiyeddine, Badji, Ameri, M., Bouzouira, N., Ameri, I., Blaha, L.F., Al-Douri, Y., Bouhemadou, A., Al-Samarai, Riyadh A., Alias, Mayson F.A.

“…[Display omitted] •The wastewater among the molecules, 2.4.6-trichlorophenol is investigated.•The adsorption mechanism of 2,4,6-trichlorophenol (TCP) is…”
Get full text

Effect of 5d state-based full-Heusler alloys on the structural, electronic and magnetic properties of new half metallic ferromagnetism by Nour-eddine, Benaissa, Belkharroubi, F., Ameri, I., Blaha, L.F., Abdelghani, Benaissa, Lamia, Drici, Bourdim, M., Tebboune, A., Belkaid, M.N., Ameri, M., Fassi, B., Driz, S., Al-Douri, Y., El-Rehim, A.F. Abd, Bouhemadou, A.

“…First-principles calculations of structural, elastic, electronic and magnetic properties of full-Heusler Ir2HfB, Ir2HfAl and Ir2HfGa have been realized by…”
Get full text

Photon attenuations of trichloride of gadolinium by Geant4 and XCom: a comparative study by Saim, A., Belkharroubi, F., Maroc, F.Z., Blaha, L.F., Ameri, I., Ameri, M., Tebboune, A., Belkaid, M.N., Al-Douri, Y.

“…The total mass attenuation coefficient of trichloride gadolinium has been investigated utilizing Geant4 compared with WinXCom simulation data at energies; 1-10…”
Get full text