“…The quality of fit is estimated by 2 (parameter for the goodness of fit), which is estimated to be 2.49, 1.58, 5.62, 2.81, and 3.27for Bi 2 Se 3 , Bi 2 Se 2 Te, Bi 2 Se 1. 5 This gap provides the opportunity to intercalate a suitable element to get desired properties such as superconductivity [14,15], etc. It can be seen in unit cells of mixed TIs that the middle Se layer remains intact in all cases this is due to the high electronegativity of Se.The high electronegativity of selenium as compared to tellurium makes Se more ionic in nature and its tendency to attract more electrons from Bi 3+ makes Se(II) position more preferable for Se as it is bonded with two of Bi atoms.…”