element(s):
['C', 'Fe']
AFLOW prototype label:
AB4_cP5_215_a_e
Parameter names:
['a', 'x2']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.088', '0.26455447']
model name:
MEAM_LAMMPS_KimJungLee_2010_FeNbC__MO_072689718616_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'Fe']
representative atom coordinates =  [[0.         0.         0.        ]
 [0.26455447 0.26455447 0.26455447]]
spacegroup =  215
cell =  [[4.088, 0, 0], [0, 4.088, 0], [0, 0, 4.088]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 20:57:31      -30.989216         5.636214
BFGS:    1 20:57:31      -32.553080         4.528009
BFGS:    2 20:57:31      -33.411679         3.638873
BFGS:    3 20:57:31      -33.973658         2.855688
BFGS:    4 20:57:31      -34.368077         2.142818
BFGS:    5 20:57:31      -34.642431         1.487160
BFGS:    6 20:57:32      -34.818041         0.882574
BFGS:    7 20:57:32      -34.907009         0.325198
BFGS:    8 20:57:32      -34.922727         0.132354
BFGS:    9 20:57:32      -34.923408         0.079157
BFGS:   10 20:57:32      -34.923723         0.014434
BFGS:   11 20:57:33      -34.923745         0.002452
BFGS:   12 20:57:33      -34.923746         0.000221
BFGS:   13 20:57:33      -34.923746         0.000019
BFGS:   14 20:57:33      -34.923746         0.000000
BFGS:   15 20:57:33      -34.923746         0.000000
Minimization converged after 15 steps.
Maximum force component: 6.149649669432834e-10 eV/Angstrom
Maximum stress component: 2.0529186629326743e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'Fe', 'Fe', 'Fe', 'Fe']
basis =  [[5.02941548e-36 0.00000000e+00 0.00000000e+00]
 [2.80070641e-01 2.80070641e-01 2.80070641e-01]
 [7.19929359e-01 7.19929359e-01 2.80070641e-01]
 [7.19929359e-01 2.80070641e-01 7.19929359e-01]
 [2.80070641e-01 7.19929359e-01 7.19929359e-01]]
cellpar =  Cell([[4.399503957855625, 8.088147347865898e-33, -1.599286017400677e-32], [2.1858302693884304e-32, 4.399503957855625, -6.792542684399691e-17], [-2.0887534790605954e-33, -6.792542684399689e-17, 4.399503957855625]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 6.14964967e-10  6.14964967e-10  6.14964967e-10]
 [-6.14964967e-10 -6.14964967e-10  6.14964967e-10]
 [-6.14964967e-10  6.14964967e-10 -6.14964967e-10]
 [ 6.14964967e-10 -6.14964967e-10 -6.14964967e-10]]
stress =  [-2.05291866e-10 -2.05291866e-10 -2.05291866e-10  5.29490252e-26
 -1.69817235e-33  4.16039529e-49]
energy per atom =  -6.984749235803858
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0