element(s):
['Fe', 'Ni']
AFLOW prototype label:
AB_tP2_123_a_d
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.5968', '1.3704174']
model name:
EAM_Dynamo_FarkasCaro_2020_FeNiCrCoAl__MO_820335782779_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Fe', 'Ni']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  123
cell =  [[2.5968, 0, 0], [0, 2.5968, 0], [0, 0, 3.5587]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:56:15       -8.771468         0.914722
BFGS:    1 15:56:15       -8.800298         0.669087
BFGS:    2 15:56:15       -8.831055         0.111933
BFGS:    3 15:56:15       -8.831248         0.089692
BFGS:    4 15:56:15       -8.832064         0.049855
BFGS:    5 15:56:15       -8.832348         0.024559
BFGS:    6 15:56:15       -8.832390         0.006341
BFGS:    7 15:56:15       -8.832392         0.001597
BFGS:    8 15:56:15       -8.832393         0.000033
BFGS:    9 15:56:15       -8.832393         0.000002
BFGS:   10 15:56:15       -8.832393         0.000000
BFGS:   11 15:56:15       -8.832393         0.000000
Minimization converged after 11 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.4280182852782376e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Ni']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.5227704544455776, -2.4047710282576765e-35, 6.1509768754684856e-33], [9.696180541934172e-36, 2.522770454445578, -1.6872386592274143e-18], [-2.4476953455533478e-33, -2.3001502160553156e-18, 3.5203228150948283]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-5.30054389e-12 -5.30054389e-12 -1.42801829e-11  2.00713967e-27
  3.46976644e-34 -3.85221459e-50]
energy per atom =  -4.416196296298351
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0