Zobrazeno 1 - 10
of 26
pro vyhledávání: '"Peiman Amiri"'
Publikováno v:
Journal of Optoelectronical Nanostructures, Vol 3, Iss 2, Pp 53-64 (2018)
Abstract: In this work we investigate the electronic, optical, dynamic and thermoelectric properties of ternary copper-based Chalcogenides CuSbX2 (X= S, Se) compounds. Calculations are based on density functional theory and the semi-classical Boltzma
Externí odkaz:
https://doaj.org/article/71061b31f9064ccaa58d35bbc8141519
Publikováno v:
Computational and Theoretical Chemistry. 1222:114053
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::9796e5c984dfe4a596e70fd96156959e
https://doi.org/10.1016/j.comptc.2023.114053
https://doi.org/10.1016/j.comptc.2023.114053
Publikováno v:
Computational Condensed Matter. 34:e00789
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::4dd95b044595d03cc50305d2f938620f
https://doi.org/10.1016/j.cocom.2023.e00789
https://doi.org/10.1016/j.cocom.2023.e00789
Publikováno v:
Solid State Communications. 360:115055
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::ea52790189a08f948c0723c6302c0451
https://doi.org/10.1016/j.ssc.2022.115055
https://doi.org/10.1016/j.ssc.2022.115055
Publikováno v:
SSRN Electronic Journal.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::484d5ebd064e20c6982fe9acd9ac4862
https://doi.org/10.2139/ssrn.4174130
https://doi.org/10.2139/ssrn.4174130
Publikováno v:
Iranian Journal of Physics Research, Vol 19, Iss 2, Pp 331-339 (2019)
Given the many applications of half-metals in the spintronics devices, we investigated the half-metallic properties of the KP compound in rock-salt (RS) and cesium chloride (CsCl) structural phases by using density functional theory. The results indi
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::167e0d328ba6904f90fe4a96abab582c
https://doi.org/10.29252/ijpr.19.2.331
https://doi.org/10.29252/ijpr.19.2.331
Publikováno v:
Journal of Magnetism and Magnetic Materials. 481:129-135
Given the various applications of half-metals in the spintronics devises, we studied the structural, electronic and magnetic properties of transition-metal (TM) (Cr, Mn, Fe, Co, Ni, and Cu) adatoms on WS2 monolayer by performing first-principles calc
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::6ae1ffe5c638fafe6d3d7d28b7ce5e4e
https://doi.org/10.1016/j.jmmm.2019.01.063
https://doi.org/10.1016/j.jmmm.2019.01.063
Publikováno v:
Journal of Physics and Chemistry of Solids. 161:110407
In this research, the (001) nano-surfaces of SbNSr3 with SbSr and NSr2 terminations are investigated using the hybrid density functional theory (DFT) calculations. The structural, energetic, and electronic properties and also surface passivation effe
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::76c4b996f5c4a0a2bdf6492f84797835
https://doi.org/10.1016/j.jpcs.2021.110407
https://doi.org/10.1016/j.jpcs.2021.110407
Publikováno v:
Solid State Communications. 343:114673
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::8a38cc599c9bb311c42c81181b857c0b
https://doi.org/10.1016/j.ssc.2022.114673
https://doi.org/10.1016/j.ssc.2022.114673
Publikováno v:
Surface Science. :13-18
First-principle calculations with different exchange-correlation functionals, including LDA, GGA, semi-empirical and ab-initio van der Waals in the forms of vdW-DF2B86R and vdW-DF2 were performed to evaluate the performance of different functionals i
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::c2ba176c5ff0fae91a9ed98f56f08f44
https://doi.org/10.1016/j.susc.2018.03.001
https://doi.org/10.1016/j.susc.2018.03.001