Publication date: Aug 13, 2019
Density functional theory calculations were used to obtain the generalized stacking fault energy surfaces in eight FCC metals: Ag, Au, Cu, Ir, Ni, Pd, Pt, and Rh. Among them, ferromagnetism was considered only in Ni. Results based on non-magnetic Ni are denoted as Ni-NM.
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fcc_gamma_surface.zip
MD5md5:75b064aea1ba37dc2fa56546e16b7328
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484.9 KiB | For each metal, there are 65 and 101 gamma surface values along the <110> and <112> directions, respectively. The first and second columns are the displacements along the <110> and <112> directions, respectively, in units of their lattice periodicity length. The third column is the GSFE values, in units of mJ/m^2. |
2019.0041/v1 (version v1) [This version] | Aug 13, 2019 | DOI10.24435/materialscloud:2019.0041/v1 |