element(s):
['Ni']
AFLOW prototype label:
A_cI2_229_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.7844']
model name:
MEAM_LAMMPS_WuLeeSu_2017_NiCrFe__MO_912636107108_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ni']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[2.7844, 0, 0], [0, 2.7844, 0], [0, 0, 2.7844]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 22:05:55       -8.577064         0.136423
BFGS:    1 22:05:55       -8.577753         0.099307
BFGS:    2 22:05:55       -8.578542         0.002043
BFGS:    3 22:05:55       -8.578542         0.000032
BFGS:    4 22:05:55       -8.578542         0.000000
BFGS:    5 22:05:55       -8.578542         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 4.732435703487545e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.7945275496493918, -4.944765105083009e-33, 1.3928010472248638e-33], [-5.160206574658138e-34, 2.7945275496493918, -4.249103177966219e-22], [-6.457116488592121e-33, -4.2491031778779975e-22, 2.7945275496493918]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-4.73243570e-15 -4.73243570e-15 -4.73243570e-15 -5.17152754e-31
 -1.39791088e-63  4.01490728e-64]
energy per atom =  -4.289271075105841
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0