element(s):
['C']
AFLOW prototype label:
A_cI8_214_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.1243']
model name:
MEAM_LAMMPS_KimJungLee_2010_FeNbC__MO_072689718616_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['C']
representative atom coordinates =  [[0.125 0.125 0.125]]
spacegroup =  214
cell =  [[4.1243, 0, 0], [0, 4.1243, 0], [0, 0, 4.1243]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:31:15      -58.274418         1.078733
BFGS:    1 16:31:15      -58.322868         1.017062
BFGS:    2 16:31:15      -58.459956         0.808621
BFGS:    3 16:31:15      -58.564795         0.587001
BFGS:    4 16:31:15      -58.635369         0.351641
BFGS:    5 16:31:15      -58.669572         0.101957
BFGS:    6 16:31:15      -58.672576         0.004257
BFGS:    7 16:31:15      -58.672582         0.000049
BFGS:    8 16:31:15      -58.672582         0.000000
BFGS:    9 16:31:15      -58.672582         0.000000
Minimization converged after 9 steps.
Maximum force component: 7.894799933443799e-31 eV/Angstrom
Maximum stress component: 1.4990023876330008e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[0.125 0.125 0.125]
 [0.375 0.875 0.625]
 [0.875 0.625 0.375]
 [0.625 0.375 0.875]
 [0.875 0.375 0.125]
 [0.625 0.625 0.625]
 [0.375 0.125 0.875]
 [0.125 0.875 0.375]]
cellpar =  Cell([[4.003139149724727, 2.859999799611508e-33, -5.804795541339314e-33], [-2.0294145216944525e-33, 4.003139149724727, -1.5776192404100792e-18], [-2.7223231791737663e-33, -1.5776192404100844e-18, 4.003139149724727]])
forces =  [[-2.63159998e-31  1.97369998e-31 -3.94739997e-31]
 [ 3.94739997e-31 -1.31579999e-31  7.89479993e-31]
 [ 3.78292497e-31  7.89479993e-31  2.96054998e-31]
 [-3.94739997e-31  1.31579999e-31 -1.31579999e-31]
 [-3.28949997e-31  4.60529996e-31  2.96054998e-31]
 [ 1.31579999e-31  1.97369998e-31  2.63159998e-31]
 [ 7.23689994e-31  3.28949997e-31  4.60529996e-31]
 [ 3.94739997e-31  4.33802809e-31  4.93424996e-31]]
stress =  [-1.49900239e-14 -1.49900239e-14 -1.49900239e-14 -3.16323392e-30
 -2.36962976e-63 -1.83497193e-63]
energy per atom =  -7.334072705130197
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0