68 citations · 175 across the 6 of their papers we have counts for
6 papers
Structurally driven asymmetric miscibility in the phase diagram of W-Ti
Mattias Ångqvist, J. Magnus Rahm, Leili Gharaee +1
Phase diagrams for multi-component systems represent crucial information for understanding and designing materials but are very time consuming to assess experimentally. Computation…
Mechanism of Re precipitation in irradiated W-Re alloys from kinetic Monte Carlo simulations
Chen-Hsi Huang, Leili Gharaee, Yue Zhao +2
High-temperature, high-dose, neutron irradiation of W results in the formation of Re-rich clusters at concentrations one order of magnitude lower than the thermodynamic solubility…
Finite-temperature properties of non-magnetic transition metals: Comparison of the performance of constraint-based semi and nonlocal functionals
Leili Gharaee, Paul Erhart, Per Hyldgaard
We assess the performance of nonempirical, truly nonlocal and semi-local functionals with regard to structural and thermal properties of , , and non-magnetic transitio…
The role of interstitial binding in radiation induced segregation in W-Re alloys
Leili Gharaee, Jaime Marian, Paul Erhart
Due to their high strength and advantageous high-temperature properties, tungsten-based alloys are being considered as plasma-facing candidate materials in fusion devices. Under ne…
Electronic and optical spectra in a diluted magnetic semiconductor multilayer
Leili Gharaee, Alireza Saffarzadeh
The effects of random distribution of magnetic impurities with concentration in a semiconductor alloy multilayer at a paramagnetic temperature are investigated by means of cohe…
Optical absorption spectrum in disordered semiconductor multilayers
Alireza Saffarzadeh, Leili Gharaee
The effects of chemical disorder on the electronic and optical properties of semiconductor alloy multilayers are studied based on the tight-binding theory and single-site coherent…