element(s):
['Fe', 'Nb']
AFLOW prototype label:
A2B_cF24_227_c_b
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['7.1184']
model name:
MEAM_LAMMPS_SaLee_2008_NbFe__MO_162036141261_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Fe', 'Nb']
representative atom coordinates =  [[0.125 0.125 0.125]
 [0.5   0.5   0.5  ]]
spacegroup =  227
cell =  [[7.1184, 0, 0], [0, 7.1184, 0], [0, 0, 7.1184]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:50:21     -132.894606         1.369888
BFGS:    1 15:50:21     -132.974169         1.340474
BFGS:    2 15:50:21     -133.169525         1.263931
BFGS:    3 15:50:21     -133.353247         1.185357
BFGS:    4 15:50:22     -133.525029         1.104713
BFGS:    5 15:50:22     -133.684556         1.021959
BFGS:    6 15:50:22     -133.831509         0.937055
BFGS:    7 15:50:22     -133.965563         0.849959
BFGS:    8 15:50:22     -134.086385         0.760629
BFGS:    9 15:50:22     -134.193637         0.669023
BFGS:   10 15:50:22     -134.286976         0.575098
BFGS:   11 15:50:22     -134.366049         0.478810
BFGS:   12 15:50:22     -134.430498         0.380113
BFGS:   13 15:50:22     -134.479960         0.278963
BFGS:   14 15:50:22     -134.514062         0.175313
BFGS:   15 15:50:22     -134.532427         0.069116
BFGS:   16 15:50:22     -134.535741         0.001391
BFGS:   17 15:50:22     -134.535743         0.000011
BFGS:   18 15:50:22     -134.535743         0.000000
Minimization converged after 18 steps.
Maximum force component: 5.453766019714693e-31 eV/Angstrom
Maximum stress component: 1.1618235870111933e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb']
basis =  [[1.25000000e-01 1.25000000e-01 1.25000000e-01]
 [8.75000000e-01 3.75000000e-01 6.25000000e-01]
 [3.75000000e-01 6.25000000e-01 8.75000000e-01]
 [6.25000000e-01 8.75000000e-01 3.75000000e-01]
 [3.75000000e-01 8.75000000e-01 6.25000000e-01]
 [8.75000000e-01 6.25000000e-01 3.75000000e-01]
 [6.25000000e-01 3.75000000e-01 8.75000000e-01]
 [1.25000000e-01 6.25000000e-01 6.25000000e-01]
 [8.75000000e-01 8.75000000e-01 1.25000000e-01]
 [3.75000000e-01 1.25000000e-01 3.75000000e-01]
 [3.75000000e-01 3.75000000e-01 1.25000000e-01]
 [8.75000000e-01 1.25000000e-01 8.75000000e-01]
 [6.25000000e-01 1.25000000e-01 6.25000000e-01]
 [1.25000000e-01 8.75000000e-01 8.75000000e-01]
 [1.25000000e-01 3.75000000e-01 3.75000000e-01]
 [6.25000000e-01 6.25000000e-01 1.25000000e-01]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 8.47437060e-33 6.23860994e-17]
 [6.23860994e-17 9.84539271e-33 5.00000000e-01]
 [6.23860994e-17 5.00000000e-01 6.23860994e-17]
 [2.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 7.50000000e-01 7.50000000e-01]
 [7.50000000e-01 2.50000000e-01 2.50000000e-01]
 [2.50000000e-01 2.50000000e-01 7.50000000e-01]]
cellpar =  Cell([[6.895512704062157, 3.798103557323731e-33, -4.397983944751289e-33], [-8.216624427449001e-33, 6.895512704062157, -3.782290888595509e-19], [-7.032191299079983e-33, -3.782290888595516e-19, 6.895512704062157]])
forces =  [[ 1.20407821e-31  4.95796911e-32 -7.08281301e-32]
 [ 7.79109431e-32 -7.08281301e-32 -1.20407821e-31]
 [ 1.69987512e-31 -1.55821886e-31  7.08281301e-32]
 [ 8.49937562e-32  2.47898455e-31  2.12484390e-31]
 [-1.13325008e-31 -3.89554716e-32  2.30191423e-32]
 [-7.08281301e-32  1.41656260e-32 -1.55821886e-31]
 [ 1.13325008e-31 -1.98318764e-31  5.66625041e-32]
 [ 1.62904699e-31  1.27490634e-31 -5.13503943e-32]
 [-1.06242195e-31  5.45376602e-31 -1.13325008e-31]
 [-9.91593822e-32  3.54140651e-32 -1.41656260e-31]
 [-8.49937562e-32  1.84153138e-31  4.24968781e-32]
 [ 1.48739073e-31 -2.12484390e-31 -4.24968781e-32]
 [ 1.13325008e-31  9.91593822e-32 -7.79109431e-32]
 [ 7.08281301e-33 -1.48739073e-31 -7.08281301e-32]
 [-6.37453171e-32  5.66625041e-32  4.24968781e-32]
 [ 1.55821886e-31  2.83312521e-32 -4.24968781e-32]
 [-4.07261748e-32  3.01019553e-32 -1.37229502e-32]
 [ 7.61402399e-32  1.59363293e-32 -8.85351627e-33]
 [-6.02039106e-32 -2.12484390e-32  2.21337907e-32]
 [ 4.78089878e-32 -7.08281301e-33  1.77070325e-33]
 [-3.54140651e-33 -7.08281301e-32  2.14697769e-32]
 [ 3.89554716e-32 -9.47326240e-32 -3.54140651e-32]
 [-7.09192380e-65  2.83312521e-32  3.64377529e-32]
 [-1.41656260e-32  4.24968781e-32 -3.89554716e-32]]
stress =  [ 1.16182359e-10  1.16182359e-10  1.16182359e-10  1.91453492e-26
  2.70032539e-36 -5.42842518e-53]
energy per atom =  -5.605655945696996
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0