Electronic structure & yield strength prediction for dislocation–Mo complex in the γ phase of nickel-based superalloys
Liu Feng-Hua1, Wang Chong-Yu1, 2, †
(color online) Dislocation–Mo interaction energy as a function of the solute position . In the immediate dislocation core, the energy values are from first principles, and at other sites, the values are calculated from classical elasticity theory.