Quantum mechanical computation of structural, electronic, and thermoelectric properties of 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 consi...

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Bibliographic Details
Main Authors: M Salimi, SH Sharifi, SJ Hashemifar
Format: Article
Language:English
Published: Isfahan University of Technology 2015-07-01
Series:Iranian Journal of Physics Research
Subjects:
Online Access:http://ijpr.iut.ac.ir/browse.php?a_code=A-10-1-703&slc_lang=en&sid=1