element(s):
['C', 'Nb']
AFLOW prototype label:
AB_hP4_194_c_a
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:
['3.1551', '1.7660613']
model name:
MEAM_LAMMPS_KimJungLee_2010_FeNbC__MO_072689718616_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'Nb']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]
 [0.         0.         0.        ]]
spacegroup =  194
cell =  [[3.1551, 0, 0], [-1.57755, 2.7323967514803, 0], [0, 0, 5.5721]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 13:06:16      -19.121973         5.417021
BFGS:    1 13:06:16      -19.656298         5.230504
BFGS:    2 13:06:16      -20.158998         4.984247
BFGS:    3 13:06:16      -20.624637         4.678388
BFGS:    4 13:06:16      -21.047223         4.308243
BFGS:    5 13:06:16      -21.420577         3.869797
BFGS:    6 13:06:16      -21.738585         3.360332
BFGS:    7 13:06:16      -21.995597         2.779486
BFGS:    8 13:06:16      -22.187130         2.131200
BFGS:    9 13:06:16      -22.311133         1.427897
BFGS:   10 13:06:16      -22.370817         0.702287
BFGS:   11 13:06:16      -22.384481         0.448813
BFGS:   12 13:06:16      -22.393548         0.526266
BFGS:   13 13:06:17      -22.420463         0.605712
BFGS:   14 13:06:17      -22.447313         0.597177
BFGS:   15 13:06:17      -22.472149         0.511234
BFGS:   16 13:06:17      -22.493887         0.367056
BFGS:   17 13:06:17      -22.511023         0.242015
BFGS:   18 13:06:17      -22.526731         0.172684
BFGS:   19 13:06:17      -22.543489         0.172226
BFGS:   20 13:06:17      -22.558610         0.144177
BFGS:   21 13:06:17      -22.565007         0.030175
BFGS:   22 13:06:17      -22.565053         0.007301
BFGS:   23 13:06:17      -22.565061         0.002732
BFGS:   24 13:06:17      -22.565062         0.001155
BFGS:   25 13:06:17      -22.565062         0.000091
BFGS:   26 13:06:17      -22.565062         0.000003
BFGS:   27 13:06:17      -22.565062         0.000000
BFGS:   28 13:06:17      -22.565062         0.000000
Minimization converged after 28 steps.
Maximum force component: 3.101578621240146e-31 eV/Angstrom
Maximum stress component: 2.4175540628766136e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'Nb', 'Nb']
basis =  [[3.33333330e-01 6.66666670e-01 2.50000000e-01]
 [6.66666663e-01 3.33333337e-01 7.50000000e-01]
 [9.99999997e-01 3.33333353e-09 2.38163688e-60]
 [9.99999997e-01 3.33333353e-09 5.00000000e-01]]
cellpar =  Cell([[3.145374400696092, -6.202665268252736e-17, 7.2590017021274705e-37], [-1.572687200348046, 2.723974135416072, -1.324806526253651e-35], [6.417998254245443e-37, 3.8245437610896143e-35, 4.180664374020024]])
forces =  [[ 3.10157862e-31 -1.79069725e-31 -3.43537779e-32]
 [-1.05477248e-68 -6.28548553e-67 -6.87075559e-32]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]]
stress =  [ 2.41755406e-10  2.41755406e-10  2.38827279e-10 -1.71373841e-33
 -4.68676106e-34  8.36151670e-26]
energy per atom =  -5.64126543332746
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0