شماره ركورد كنفرانس :
815
عنوان مقاله :
Theoretical investigation on the structural, magnetic, electronic and
پديدآورندگان :
Jalali Asadabadi نويسنده , Pourmasoud نويسنده
كليدواژه :
UPtGe crystal , UPtGe crystal , Optical properties , FPLAPW , Optical properties
عنوان كنفرانس :
شانزدهمين كفنراسن اپتيك و فوتونيك ايران و دومين كنفرانس مهندسي فوتونيك ايران
چكيده فارسي :
Abstract: Structural, magnetic, electronic and
optical properties of UPtGe compound were
calculated within the density functional theory
(DFT) using the PBE-GGA for the exchangecorrelation
functional. The imaginary and real
parts of the dielectric function were calculated by
the random phase approximation (RPA) and
Kramers-Kronig relations, respectively. The
result shows that the imaginary part is a broad
function of the energy. The later result
indicates that there may be strong interactions
among valence states. The later result thereby
indicates that the valence states may be highly
hybridized to each other.
Keywords: , , , GGA
شماره مدرك كنفرانس :
1845181