A spectral neighbor analysis potential for Ni developed by Yunxing Zuo v000
A spectral neighbor analysis potential for Ni. The potential is trained against diverse and large materials data, including bulk fcc Ni, strained fcc Ni, ab-initio molecular dynamics (AIMD) simulated random structures, melted structures, vacancy-containing structures, surfaces. The potential gives accurate predictions of structural energies, forces, elasticity, lattice parameters, vacancy formation energy, vacancy migration energy, equation-of-state, phonon.
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