Multiscale energy density algorithm and application to surface structure of Ni matrix of superalloy

Sun Min¹, Wang Chong-Yu^{2, †}, Liu Ji-Ping^{1, ‡}

(color online) Comparison between calculated multilayer relaxation Δd_{n,n + 1} values of the Ni (002) surface obtained by using EDM and FLWMS. The relative surface atomic structure is given in Fig. 1.