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An alternative approach on the calculation of cohesive energy density and isothermal compressibility of alkali metal halides
(TAYLOR & FRANCIS LTD, 2017)
In the present paper, new and useful theoreticalmethods for the estimation of cohesive energy density (Ced) and isothermal compressibility (k(T)) of alkali metal halides are described. The mentioned theoretical methods ...
New insights from the relation between lattice energy and bond stretching force constant in simple ionic compounds
(PERGAMON-ELSEVIER SCIENCE LTD, 2017)
Lattice energy and bond stretching force constant are two quantities considered in many fields of chemistry and physics. Both quantities can be used to describe the stability or reactivity of a simple system. In the present ...
A novel lattice energy calculation technique for simple inorganic crystals
(ELSEVIER SCIENCE BV, 2017)
In this pure theoretical study, a hitherto unexplored equation based on Shannon radii of the ions forming that crystal and chemical hardness of any crystal to calculate the lattice energies of simple inorganic ionic crystals ...