سلیمی, مرضیه

[ 1 ] - محاسبه کوانتمی خواص ساختاری، الکترونی و ترموالکتریکی بلور AgSbSe2

In this work, density functional calculations and Boltzmann semiclassical theory of transport are used to investigate structural, electronic, and thermoelectric properties of AgSbSe2 crystal. According to the published experimental measurements, five more likely structures of this compound are considered and their structural and electronic properties are calculated and compared together. Then, ...