Site preferences of alloying transition metal elements in Ni-based superalloy: A first-principles study

Lu Baokun¹, Wang Chong-Yu^{1, †}, Du Zhihui²

The binding energies calculated with spinpolarization (a) and without spinpolarization (b) between X(Re)–Y(3d, 4d, 5d transition metal and Al) pairs in Ni₁₀₆XY system at 1^st and 2^nd distances.