Articles

type: Conference
Title Date
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محاسبه دقيق ساختار الكتروني مواد عايق و نيمرسانا شامل الكترونهاي همبسته قوي، بر مبناي نظريه تابعي چگالي
بررسي خواص نانوخوشه هاي MoSe2 و MoS2 با استفاده از الگوريتم تكاملي و نظريه تابعي چگالي
بررسي ابتدا به ساكن نانوخوشههاي استوكيومتري (WS2)n
type: Journal
Title DOI Date
Size effects on the structural electronic and optical properties of (5 0) finite-length carbon nanotube An ab-initio electronic structure study 10.1063/1.4955221
Density functional study of CaN monolayer on Si(001) 10.1016/j.jmmm.2015.08.069
First-principles calculation of semiclassical thermoelectric properties of (AgSbSe2)n(AgSbTe2)n superlattices #
First-principles insights into f magnetism A case study on some magnetic pyrochlores #
Density-functional study of the pure and palladium doped small copper and silver clusters #
بررسي ابتدا به ساكن خواص ساختاري، مغناطيسي و الكتروني نانوخوشه هاي مس و نقره و آلياژ آنها با يك اتم پالاديم #
Density functional investigation of spin polarization in bulk and thin films of nitrogen intercalated Cu3N #
Twin boundary energy and characterization of charge redistribution near the twin boundaries of cupperate superconductors #
Thermoelectric properties of AgSbTe2 from first-principles calculations #
First-principles insights into interaction of Au with small Co clusters #
D0 magnetism in Ca doped narrow carbon nanotubes First principle chirality effect study #
First-principles insights into interaction of CO NO and HCN with Ag8 #
Ab-initio study of hydrogen doping and oxygen vacancy at anatase TiO2 surface #
Density functional study of CaN mono and bilayer on Cu(001) #
نانوساختارهاي بي نظم سيليكون جايگزيدگي و گاف انرژي #
First-principles study of H2 adsorption on the pristine and oxidized (8 0) carbon nanotube #