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Anisotropic mechanical properties of Tl4Ag18Te11 compound with low thermal conductivity
(Academic Press Inc., 2020)
The anisotropic mechanical properties of Tl4Ag18Te11 compound was investigated elaborately for the first time by using Density Functional Theory calculations with the Vienna Ab-initio Simulation Package in this work. ...
Prediction of new stable crystal structures for ternary ErAgTe2 and YAgTe2 semiconductors: Ab initio study
(Elsevier Masson s.r.l., 2023)
The crystal structure, electronic, mechanical, and phonon properties of rare-earth ErAgTe2 and YAgTe2 compounds have been investigated using first-principles calculations based on density functional theory. We consider ...
