element(s):
['Cr']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.6528']
model name:
Sim_LAMMPS_EAM_EichBeinkeSchmitz_2015_FeCr__SM_731771351835_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cr']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[3.6528, 0, 0], [0, 3.6528, 0], [0, 0, 3.6528]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:17:18      -15.041127         1.004423
BFGS:    1 16:17:19      -15.081850         0.887342
BFGS:    2 16:17:19      -15.183671         0.467068
BFGS:    3 16:17:19      -15.221000         0.027402
BFGS:    4 16:17:19      -15.221125         0.000648
BFGS:    5 16:17:20      -15.221125         0.000001
BFGS:    6 16:17:20      -15.221125         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.0809471172331504e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cr', 'Cr', 'Cr', 'Cr']
basis =  [[0.  0.  0. ]
 [0.  0.5 0.5]
 [0.5 0.  0.5]
 [0.5 0.5 0. ]]
cellpar =  Cell([[3.7600034989007574, 2.4945659930735064e-33, 5.2797192492907666e-33], [-2.2511618866726919e-35, 3.7600034989007574, -8.294084255497243e-18], [-8.821875154909052e-33, -8.29408425549723e-18, 3.7600034989007574]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.08094712e-12 -2.08094712e-12 -2.08094712e-12  2.23222943e-28
  4.15266648e-60 -2.02679122e-61]
energy per atom =  -3.805281356984871
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0