element(s):
['C']
AFLOW prototype label:
A_hP4_194_bc
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.4677', '3.3769097']
model name:
MEAM_LAMMPS_LiyanageKimHouze_2014_FeC__MO_075279800195_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'C']
representative atom coordinates =  [[0.         0.         0.25      ]
 [0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[2.4677, 0, 0], [-1.23385, 2.1370908889189, 0], [0, 0, 8.3332]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 10:56:44      -29.322976         1.550693
BFGS:    1 10:56:44      -29.383541         1.185849
BFGS:    2 10:56:44      -29.463100         0.417856
BFGS:    3 10:56:44      -29.475209         0.030727
BFGS:    4 10:56:44      -29.475277         0.001696
BFGS:    5 10:56:44      -29.475277         0.001695
BFGS:    6 10:56:45      -29.475277         0.001694
BFGS:    7 10:56:45      -29.475278         0.001686
BFGS:    8 10:56:45      -29.475278         0.003005
BFGS:    9 10:56:45      -29.475281         0.005524
BFGS:   10 10:56:45      -29.475285         0.008902
BFGS:   11 10:56:45      -29.475296         0.012539
BFGS:   12 10:56:45      -29.475312         0.013578
BFGS:   13 10:56:45      -29.475328         0.009016
BFGS:   14 10:56:45      -29.475334         0.002812
BFGS:   15 10:56:46      -29.475334         0.000389
BFGS:   16 10:56:46      -29.475334         0.000029
BFGS:   17 10:56:46      -29.475334         0.000009
BFGS:   18 10:56:46      -29.475334         0.000000
BFGS:   19 10:56:46      -29.475334         0.000000
Minimization converged after 19 steps.
Maximum force component: 9.980565768097999e-31 eV/Angstrom
Maximum stress component: 3.558589721009076e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C']
basis =  [[8.06585423e-36 1.82593456e-36 2.50000000e-01]
 [0.00000000e+00 2.33786005e-35 7.50000000e-01]
 [3.33333333e-01 6.66666667e-01 2.50000000e-01]
 [6.66666667e-01 3.33333333e-01 7.50000000e-01]]
cellpar =  Cell([[2.5303740373093495, 3.05955338933364e-20, -1.3743617663840666e-37], [-1.2651870186546748, 2.19136819738649, -1.7977261296972063e-36], [-1.8509510044995976e-36, -3.9749002491565713e-35, 8.48057888683974]])
forces =  [[ 1.85666769e-72  3.98717678e-71 -8.50677126e-36]
 [ 9.98056577e-31 -5.76228233e-31  8.50677126e-36]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]]
stress =  [-3.55858972e-10 -3.55858972e-10 -2.94300850e-11 -3.45444576e-36
 -5.89103047e-47  1.22287146e-25]
energy per atom =  -7.368833549618651
===============================================