element(s):
['Fe', 'N']
AFLOW prototype label:
A3B_hP8_182_g_c
Parameter names:
['a', 'c/a', 'x2']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.9634', '0.91527985', '0.69108464']
model name:
MEAM_LAMMPS_LeeLeeKim_2006_FeN__MO_432861766738_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Fe', 'N']
representative atom coordinates =  [[0.69108464 0.         0.        ]
 [0.33333333 0.66666667 0.25      ]]
spacegroup =  182
cell =  [[4.9634, 0, 0], [-2.4817, 4.2984304891437, 0], [0, 0, 4.5429]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 03:04:23      -34.706756        1.8036
BFGS:    1 03:04:23      -34.955428        1.7262
BFGS:    2 03:04:23      -35.383661        1.5438
BFGS:    3 03:04:23      -35.737618        1.3204
BFGS:    4 03:04:23      -36.008232        1.0496
BFGS:    5 03:04:23      -36.194812        0.7807
BFGS:    6 03:04:23      -36.294473        0.4703
BFGS:    7 03:04:23      -36.319253        0.2636
BFGS:    8 03:04:23      -36.327840        0.2642
BFGS:    9 03:04:23      -36.378207        0.1644
BFGS:   10 03:04:23      -36.389540        0.5472
BFGS:   11 03:04:23      -36.391975        0.0812
BFGS:   12 03:04:23      -36.393080        0.0493
BFGS:   13 03:04:23      -36.393703        0.0074
BFGS:   14 03:04:23      -36.393720        0.0027
BFGS:   15 03:04:23      -36.393720        0.0028
BFGS:   16 03:04:23      -36.393721        0.0028
BFGS:   17 03:04:23      -36.393722        0.0013
BFGS:   18 03:04:23      -36.393722        0.0035
BFGS:   19 03:04:23      -36.393723        0.0010
BFGS:   20 03:04:23      -36.393723        0.0008
BFGS:   21 03:04:23      -36.393723        0.0003
BFGS:   22 03:04:23      -36.393723        0.0000
BFGS:   23 03:04:23      -36.393723        0.0000
BFGS:   24 03:04:23      -36.393723        0.0000
BFGS:   25 03:04:23      -36.393723        0.0000
Minimization converged after 25 steps.
Maximum force component: 8.312356926906473e-11 eV/Angstrom
Maximum stress component: 3.967987347467941e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'N', 'N']
basis =  [[6.67982808e-01 1.50874781e-33 1.44971367e-33]
 [4.99999983e-09 6.67982803e-01 1.01686814e-34]
 [3.32017202e-01 3.32017197e-01 1.30066194e-33]
 [3.32017202e-01 0.00000000e+00 5.00000000e-01]
 [4.99999979e-09 3.32017197e-01 5.00000000e-01]
 [6.67982808e-01 6.67982803e-01 5.00000000e-01]
 [3.33333338e-01 6.66666667e-01 2.50000000e-01]
 [6.66666672e-01 3.33333333e-01 7.50000000e-01]]
cellpar =  Cell([[4.716753500067795, -2.912954182434887e-17, 1.8826993088773732e-38], [-2.3583767500338975, 4.084828354447878, 9.151138008520765e-40], [-2.390679765928633e-37, 1.8476479386812673e-37, 4.315971550574743]])
forces =  [[-8.31235693e-11  5.14156879e-28 -5.67450204e-31]
 [ 4.15617846e-11 -7.19871226e-11  9.93037857e-31]
 [ 4.15617846e-11  7.19871226e-11  1.41862551e-31]
 [ 8.31235693e-11 -5.12881361e-28  1.27676296e-30]
 [-4.15617846e-11  7.19871226e-11 -1.13490041e-30]
 [-4.15617846e-11 -7.19871226e-11 -1.41862551e-31]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [-8.52697642e-31  2.68530116e-31  2.12793827e-31]]
stress =  [-1.27090025e-11 -1.27090025e-11 -3.96798735e-10 -2.72928093e-47
 -6.45843703e-33 -1.69713758e-27]
energy per atom =  -4.549215347115365
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0