element(s):
['C']
AFLOW prototype label:
A_cP20_221_gj
Parameter names:
['a', 'x1', 'y2']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.215', '0.26228631', '0.15146094']
model name:
MEAM_LAMMPS_KimJungLee_2010_FeNbC__MO_072689718616_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'C']
representative atom coordinates =  [[0.26228631 0.26228631 0.26228631]
 [0.5        0.15146094 0.15146094]]
spacegroup =  221
cell =  [[5.215, 0, 0], [0, 5.215, 0], [0, 0, 5.215]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 17:33:32     -141.807035         6.285295
BFGS:    1 17:33:32     -144.223440         1.799064
BFGS:    2 17:33:32     -144.866850         0.532932
BFGS:    3 17:33:32     -144.917360         0.314983
BFGS:    4 17:33:32     -144.923112         0.301096
BFGS:    5 17:33:32     -144.935733         0.258006
BFGS:    6 17:33:32     -144.955630         0.318820
BFGS:    7 17:33:33     -144.976239         0.301272
BFGS:    8 17:33:33     -144.988063         0.122734
BFGS:    9 17:33:33     -144.989520         0.021207
BFGS:   10 17:33:33     -144.989610         0.001010
BFGS:   11 17:33:34     -144.989611         0.000072
BFGS:   12 17:33:34     -144.989611         0.000002
BFGS:   13 17:33:34     -144.989611         0.000000
BFGS:   14 17:33:34     -144.989611         0.000000
Minimization converged after 14 steps.
Maximum force component: 1.8494790640730095e-10 eV/Angstrom
Maximum stress component: 1.1848387782598074e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[0.2675626  0.2675626  0.2675626 ]
 [0.7324374  0.7324374  0.2675626 ]
 [0.7324374  0.2675626  0.7324374 ]
 [0.2675626  0.7324374  0.7324374 ]
 [0.2675626  0.2675626  0.7324374 ]
 [0.7324374  0.7324374  0.7324374 ]
 [0.2675626  0.7324374  0.2675626 ]
 [0.7324374  0.2675626  0.2675626 ]
 [0.5        0.16328401 0.16328401]
 [0.5        0.83671599 0.16328401]
 [0.5        0.16328401 0.83671599]
 [0.5        0.83671599 0.83671599]
 [0.16328401 0.5        0.16328401]
 [0.16328401 0.5        0.83671599]
 [0.83671599 0.5        0.16328401]
 [0.83671599 0.5        0.83671599]
 [0.16328401 0.16328401 0.5       ]
 [0.83671599 0.16328401 0.5       ]
 [0.16328401 0.83671599 0.5       ]
 [0.83671599 0.83671599 0.5       ]]
cellpar =  Cell([[5.172245265849717, 1.0632796745618006e-32, -6.623977231984714e-33], [1.1258140054736339e-32, 5.172245265849717, -4.2935599612945566e-19], [6.608336003610706e-33, -4.2935599612946086e-19, 5.172245265849717]])
forces =  [[-2.58750413e-11 -2.58750413e-11 -2.58750413e-11]
 [ 2.58750413e-11  2.58750413e-11 -2.58750413e-11]
 [ 2.58750413e-11 -2.58750413e-11  2.58750413e-11]
 [-2.58750413e-11  2.58750413e-11  2.58750413e-11]
 [-2.58750413e-11 -2.58750413e-11  2.58750413e-11]
 [ 2.58750413e-11  2.58750413e-11  2.58750413e-11]
 [-2.58750413e-11  2.58750413e-11 -2.58750413e-11]
 [ 2.58750413e-11 -2.58750413e-11 -2.58750413e-11]
 [-1.70007587e-31  1.84947906e-10  1.84947906e-10]
 [-1.66266579e-43 -1.84947906e-10  1.84947906e-10]
 [ 1.66266579e-43  1.84947906e-10 -1.84947906e-10]
 [ 3.40015174e-31 -1.84947906e-10 -1.84947906e-10]
 [ 1.84947906e-10 -1.53103069e-29  1.84947906e-10]
 [ 1.84947906e-10  1.52678050e-29 -1.84947906e-10]
 [-1.84947906e-10 -1.53528088e-29  1.84947906e-10]
 [-1.84947906e-10  1.55228164e-29 -1.84947906e-10]
 [ 1.84947906e-10  1.84947906e-10 -1.53528088e-29]
 [-1.84947906e-10  1.84947906e-10 -1.54165616e-29]
 [ 1.84947906e-10 -1.84947906e-10  1.54378126e-29]
 [-1.84947906e-10 -1.84947906e-10  1.54378126e-29]]
stress =  [1.18483878e-11 1.18483878e-11 1.18483878e-11 3.84121192e-30
 9.21493410e-34 4.59924121e-53]
energy per atom =  -7.249480532127803
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0