59 citations · 157 across the 9 of their papers we have counts for
9 papers
Theoretical study of -U/W(110) thin films from density functional theory calculations: Structural, magnetic and electronic properties
M. Zarshenas, S. Jalali Asadabadi
Structural, electronic and magnetic properties were calculated for the optimized -U/W(110) thin films (TFs) within the density functional theory. Our optimization for 1U/7W(110)…
Ab initio prediction of magnetically dead layers in freestanding -Ce(111)
S. Jalali Asadabadi, F. Kheradmand
It is well known that the surface of nonmagnetic -Ce is magnetically ordered, i.e., -like. One then might conjecture, in agreement with previous theoretical predictions, that…
Quantum Size Effects in Pb/Si(111) Thin Films from Density Functional Calculations
M. Rafiee, S. Jalali Asadabadi
The Pb/Si(111) thin films were simulated within the density functional theory (DFT). The well-known Perdew-Burke-Ernzerhof (PBE) version of the generalized gradient approximation (…
Density functional approach to study structural properties and Electric Field Gradients in rare earth materials
S. Jalali Asadabadi, H. Akbarzadeh
We investigated the effect of spin polarization on the structural properties and gradient of electric field (EFG) on Sn, In, and Cd impurity in RSn (R=Sm, Eu, Gd) and RIn (…
Electronic structure and electric-field gradients analysis in
S. Jalali Asadabadi
Electric field gradients (EFG's) were calculated for the compound at both and sites. The calculations were performed within the density functional th…
Hyperfine Interaction in USb2 Crystal
A. Fathi, S. Jalali Asadabadi, M. G. Rad +1
The hyperfine interactions at the uranium site in the antiferromagnetic USb2 compound were calculated within the density functional theory (DFT) employing augmented plane wave plus…