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_Lee_2006_FeC__MO_856956178669_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 17:44:47      -87.969989         0.389818
BFGS:    1 17:44:47      -87.974185         0.363455
BFGS:    2 17:44:47      -87.998517         0.121681
BFGS:    3 17:44:47      -88.001500         0.003459
BFGS:    4 17:44:47      -88.001504         0.002114
BFGS:    5 17:44:47      -88.001504         0.001377
BFGS:    6 17:44:47      -88.001505         0.000172
BFGS:    7 17:44:47      -88.001505         0.000028
BFGS:    8 17:44:47      -88.001505         0.000001
BFGS:    9 17:44:47      -88.001505         0.000000
BFGS:   10 17:44:47      -88.001505         0.000000
Minimization converged after 10 steps.
Maximum force component: 9.294942180643906e-10 eV/Angstrom
Maximum stress component: 6.162441673276122e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[4.88819528e-35 0.00000000e+00 2.50000000e-01]
 [0.00000000e+00 1.74787250e-35 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([[2.451340887932596, 2.508411910893298e-18, 1.4739187399091118e-38], [-1.225670443966298, 2.122923482285131, -1.5010667208172006e-38], [-1.5335622615570741e-37, 6.211655344032262e-37, 34.42599991844354]])
forces =  [[ 3.02151092e-31 -1.04668209e-31  2.72433947e-65]
 [-1.20860437e-31  6.97788058e-32 -9.77854051e-70]
 [-3.02151092e-31  1.04668209e-31  8.17214101e-65]
 [ 1.20860437e-31 -6.97788058e-32  9.77854051e-70]
 [-3.02151092e-31  2.44225820e-31 -9.29494218e-10]
 [ 3.22294499e-31 -1.64415310e-47 -9.29494218e-10]
 [ 3.02151092e-31 -2.44225820e-31  9.29494218e-10]
 [-3.22294499e-31  1.64415310e-47  9.29494218e-10]
 [-3.02151092e-31  2.44225820e-31 -9.29494218e-10]
 [ 3.22294499e-31 -1.64415310e-47 -9.29494218e-10]
 [ 3.02151092e-31 -2.44225820e-31  9.29494218e-10]
 [-3.22294499e-31  1.64415310e-47  9.29494218e-10]]
stress =  [-6.16244167e-12 -6.16244167e-12  1.99659991e-21 -6.28289208e-43
 -3.62743035e-43 -2.96165753e-28]
energy per atom =  -7.333458714361696
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0