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. 2020 Jun 1;5(22):13403–13408. doi: 10.1021/acsomega.0c01649

Table 2. List of Descriptors Considered in the Present Study.

elemental information crystal structure information
atomic number Z lattice volume V
atomic mass m lattice constant a, b, c
electronegativity EN angle formed by basic vector α, β, γ
covalent radius CR substituted positions of X1 and X2x, y, z
first-ionization energy IE  
maximum oxidation state O  
coefficient of van der Waals C6