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pro vyhledávání: '"Mandana Safari"'
Charge transfer from a metal substrate stabilizes honeycomb borophene, whose electron deficit would otherwise spoil the hexagonal order of a π-bonded two-dimensional (2D) atomic network. However, the coupling between the substrate and the boron over
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::742116595d3ed919cd96179277e4c3e2
Autor:
Mandana Safari, Jaafar Jalilian
Publikováno v:
Physics Letters A. 381:1313-1320
Using ab initio study, the structural, electronic and optical properties of α-InX ( X = S , Se and Te) are investigated under tensile and compressive strain conditions. The results illustrate that exerting biaxial tensile and compressive strain cond
Publikováno v:
Physics Letters A. 381:663-670
In this paper, we explore the structural, electronic and optical properties of ZnX and CdX (X = S, Se and Te) compounds in the two-dimensional (2D) graphene-like structure using the full potential augmented plane waves plus local orbitals ( FP-APW +
Electronic and optical properties of beryllium sulfide monolayer: Under stress and strain conditions
Autor:
Mandana Safari, Jaafar Jalilian
Publikováno v:
Physics Letters A. 380:3546-3552
Electronic and optical properties of two-dimensional graphene-like structure of beryllium sulfide (BeS) have been studied in the framework of the density functional theory. Different values of stress and strain are exerted for tuning electronic and o
Publikováno v:
Physica E: Low-dimensional Systems and Nanostructures. 83:426-433
Using first principle study, we investigate the structural, electronic and optical properties of lithium halide monolayers (LiF, LiCl, LiBr). In contrast to graphene and other graphene-like structures that form hexagonal rings in plane, these compoun
Autor:
Jaafar Jalilian, Mandana Safari
Publikováno v:
Diamond and Related Materials. 66:163-170
Electronic and optical properties of boron nitride monolayer have been studied by full potential augmented plane waves plus local orbital (FP-APW + lo) in the framework of the density functional theory. For achieving new applications, biaxial stress
Publikováno v:
Nanoscale; 12/7/2023, Vol. 15 Issue 45, p18097-18107, 11p
Autor:
Biasin, Pietro, Safari, Mandana, Ghidorsi, Elena, Baronio, Stefania, Scardamaglia, Mattia, Preobrajenski, Alexei, de Gironcoli, Stefano, Baroni, Stefano, Vesselli, Erik
Publikováno v:
Nanoscale; 12/7/2023, Vol. 15 Issue 45, p18407-18414, 8p