We have carried out first-principles density functional calculations on the mechanical
response of two-dimensional (2D) monolayer group VI transition metal dichalcogenides …

In the present work, the structural and hitherto unexplored thermal and mechanical
properties of NaInS 2-x Se x (x= 0, 0.5, 1.0, 1.5 and 2.0) compounds have been studied …

Large single crystals of LiGaSe 2 were grown and their spectroscopic properties were
studied. As-grown LiGaSe 2 crystals are transparent in the 0.5–14 μm spectral region as …

Detailed first principles calculations of the structural, electronic and optical properties of two
representatives of the chalcopyrite group of compounds (LiInSe 2 and LiInTe 2) are reported …

Complex first-order linear optical dispersion and complex second-order non-linear optical
dispersion of LiInX 2 (X= Se, Te) chalcopyrite single crystals were calculated in the …

For the couple of chalcopyrite compounds, we have theoretically studied the various
properties for example structural, electronic optical and mechanical properties. The band …

The most prominent aspects of ternary-type chalcogenides are their tunable optical abilities
and outstanding thermoelectric stability. Here the advanced density functional theory is used …

Abstract Novel AgGa 0.95 In 0.05 Ge 3 Se 8 single crystalline alloys were grown via
Bridgman–Stockbarger route and characterized by XRD analysis. The titled compounds …

Measurements of X-ray photoelectron core-level and valence-band spectra for pristine and
irradiated with Ar+ ions surfaces of LiGa 0.5 In 0.5 Se 2 single crystal, novel nonlinear …

In the chalcopyrite (or tetragonal) phase, different physical properties of the ternary LiMX2
(M= Al, Ga, In and X= S, Se, Te) compounds are studied by the very accurate density …