element(s):
['C', 'Nb']
AFLOW prototype label:
AB_cF8_216_a_c
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.8303']
model name:
MEAM_LAMMPS_KimJungLee_2010_FeNbC__MO_072689718616_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'Nb']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.25 0.25 0.25]]
spacegroup =  216
cell =  [[4.8303, 0, 0], [0, 4.8303, 0], [0, 0, 4.8303]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 19:06:15      -45.009029         4.628250
BFGS:    1 19:06:15      -45.693348         4.493481
BFGS:    2 19:06:15      -46.356289         4.343015
BFGS:    3 19:06:15      -46.995410         4.175693
BFGS:    4 19:06:15      -47.608093         3.990289
BFGS:    5 19:06:15      -48.191528         3.785511
BFGS:    6 19:06:15      -48.742709         3.559992
BFGS:    7 19:06:15      -49.258416         3.312286
BFGS:    8 19:06:15      -49.735217         3.041089
BFGS:    9 19:06:15      -50.169453         2.744296
BFGS:   10 19:06:15      -50.557154         2.420427
BFGS:   11 19:06:15      -50.894146         2.067857
BFGS:   12 19:06:16      -51.175977         1.684609
BFGS:   13 19:06:16      -51.397894         1.268669
BFGS:   14 19:06:16      -51.554838         0.817929
BFGS:   15 19:06:16      -51.641423         0.330173
BFGS:   16 19:06:16      -51.657214         0.022192
BFGS:   17 19:06:16      -51.657284         0.000546
BFGS:   18 19:06:16      -51.657284         0.000001
BFGS:   19 19:06:16      -51.657284         0.000000
Minimization converged after 19 steps.
Maximum force component: 3.670862802424409e-31 eV/Angstrom
Maximum stress component: 3.0313390330068488e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'Nb', 'Nb', 'Nb', 'Nb']
basis =  [[1.27385016e-34 1.15555797e-33 1.27500447e-34]
 [1.15693956e-33 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.41408455e-33]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]]
cellpar =  Cell([[4.358279587760811, 3.8368530666693944e-33, -1.0193984291235301e-32], [1.1676963325595472e-32, 4.358279587760811, 2.970912707972302e-17], [-9.656795870433745e-33, 2.9709127079723016e-17, 4.358279587760811]])
forces =  [[-1.79066478e-32  8.95332391e-33 -5.37199435e-32]
 [ 2.68599717e-32  2.68599717e-32  8.95332391e-33]
 [ 1.79066478e-32  1.79066478e-32  2.68599717e-32]
 [ 1.79066478e-32  8.95332391e-33  8.95332391e-33]
 [ 8.95332391e-33 -2.59646393e-31  2.14879774e-31]
 [ 2.79791372e-32  2.77553041e-31  1.41014852e-31]
 [-3.65798705e-64 -2.32786422e-31 -1.16393211e-31]
 [ 4.47666195e-32  3.67086280e-31 -1.25346535e-31]]
stress =  [-3.03133903e-12 -3.03133903e-12 -3.03133903e-12 -5.22530277e-28
 -2.16306231e-34 -5.26012223e-50]
energy per atom =  -6.457160452105852
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0