element(s):
['C']
AFLOW prototype label:
A_hP12_194_bc2f
Parameter names:
['a', 'c/a', 'z3', 'z4']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.4678', '13.950077', '0.86916696', '0.13083843']
model name:
MEAM_LAMMPS_NouranianTschoppGwaltney_2014_CH__MO_354152387712_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'C', 'C', 'C']
representative atom coordinates =  [[0.         0.         0.25      ]
 [0.33333333 0.66666667 0.25      ]
 [0.33333333 0.66666667 0.86916696]
 [0.33333333 0.66666667 0.13083843]]
spacegroup =  194
cell =  [[2.4678, 0, 0], [-1.2339, 2.1371774914592, 0], [0, 0, 34.426]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:48:24      -70.913011         0.777658
BFGS:    1 16:48:24      -70.929960         0.747948
BFGS:    2 16:48:24      -70.997976         0.611679
BFGS:    3 16:48:24      -71.052154         0.471159
BFGS:    4 16:48:24      -71.092063         0.326293
BFGS:    5 16:48:24      -71.117265         0.176981
BFGS:    6 16:48:24      -71.127308         0.023123
BFGS:    7 16:48:24      -71.127479         0.000399
BFGS:    8 16:48:24      -71.127479         0.000132
BFGS:    9 16:48:24      -71.127479         0.000128
BFGS:   10 16:48:24      -71.127479         0.000048
BFGS:   11 16:48:24      -71.127479         0.000014
BFGS:   12 16:48:24      -71.127479         0.000000
BFGS:   13 16:48:24      -71.127479         0.000000
BFGS:   14 16:48:24      -71.127479         0.000000
Minimization converged after 14 steps.
Maximum force component: 7.2621572278498e-11 eV/Angstrom
Maximum stress component: 1.2596167330427729e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[0.00000000e+00 2.98420052e-35 2.50000000e-01]
 [0.00000000e+00 0.00000000e+00 7.50000000e-01]
 [3.33333333e-01 6.66666667e-01 2.50000000e-01]
 [6.66666667e-01 3.33333333e-01 7.50000000e-01]
 [3.33333333e-01 6.66666667e-01 8.69164265e-01]
 [6.66666667e-01 3.33333333e-01 3.69164265e-01]
 [6.66666667e-01 3.33333333e-01 1.30835735e-01]
 [3.33333333e-01 6.66666667e-01 6.30835735e-01]
 [3.33333333e-01 6.66666667e-01 1.30835735e-01]
 [6.66666667e-01 3.33333333e-01 6.30835735e-01]
 [6.66666667e-01 3.33333333e-01 8.69164265e-01]
 [3.33333333e-01 6.66666667e-01 3.69164265e-01]]
cellpar =  Cell([[2.4125837185831696, -2.2229497264325107e-18, 5.5975105880133665e-40], [-1.2062918592915848, 2.0893587890497516, -2.789283353239347e-40], [-6.752710727037953e-41, -1.9995260183732135e-39, 34.425999967209165]])
forces =  [[ 9.91246342e-32 -1.03013342e-31  1.68562249e-69]
 [-1.58599415e-31  6.86755611e-32 -2.11510473e-69]
 [-9.91246342e-32  1.03013342e-31 -1.68562249e-69]
 [ 1.58599415e-31 -6.86755611e-32  2.11510473e-69]
 [ 1.98249268e-31 -6.86755611e-32 -7.26215723e-11]
 [-3.96498537e-32  6.86755611e-32 -7.26215723e-11]
 [-1.98249268e-31  6.86755611e-32  7.26215723e-11]
 [ 3.96498537e-32 -6.86755611e-32  7.26215723e-11]
 [ 7.92997073e-32 -6.88485931e-50 -7.26215723e-11]
 [-1.58599415e-31  1.37351122e-31 -7.26215723e-11]
 [-7.92997073e-32  6.88485931e-50  7.26215723e-11]
 [ 1.58599415e-31 -1.37351122e-31  7.26215723e-11]]
stress =  [-1.25961673e-11 -1.25961673e-11  1.09893949e-22  6.64981800e-43
  9.21425812e-44 -1.38013567e-28]
energy per atom =  -5.927289914125389
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0