element(s):
['C']
AFLOW prototype label:
A_hP12_194_e2f
Parameter names:
['a', 'c/a', 'z1', 'z2', 'z3']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.5213', '4.9308293', '0.18686753', '0.52076763', '0.6450971']
model name:
MEAM_LAMMPS_LeeLee_2005_C__MO_996970420049_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'C', 'C']
representative atom coordinates =  [[0.         0.         0.18686753]
 [0.33333333 0.66666667 0.52076763]
 [0.33333333 0.66666667 0.6450971 ]]
spacegroup =  194
cell =  [[2.5213, 0, 0], [-1.26065, 2.1835098505617, 0], [0, 0, 12.4321]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 17:48:11      -88.085346         3.271380
BFGS:    1 17:48:11      -88.038316         2.486035
BFGS:    2 17:48:11      -88.236797         0.988037
BFGS:    3 17:48:11      -88.254092         0.640296
BFGS:    4 17:48:11      -88.262824         0.302231
BFGS:    5 17:48:11      -88.264546         0.279422
BFGS:    6 17:48:11      -88.273872         0.112718
BFGS:    7 17:48:11      -88.275149         0.080982
BFGS:    8 17:48:11      -88.276026         0.007160
BFGS:    9 17:48:11      -88.276032         0.003922
BFGS:   10 17:48:11      -88.276033         0.004028
BFGS:   11 17:48:11      -88.276034         0.003609
BFGS:   12 17:48:11      -88.276036         0.002764
BFGS:   13 17:48:11      -88.276037         0.001813
BFGS:   14 17:48:11      -88.276037         0.000465
BFGS:   15 17:48:11      -88.276037         0.000034
BFGS:   16 17:48:11      -88.276037         0.000003
BFGS:   17 17:48:11      -88.276037         0.000000
BFGS:   18 17:48:11      -88.276037         0.000000
Minimization converged after 18 steps.
Maximum force component: 2.953709499209367e-09 eV/Angstrom
Maximum stress component: 1.3260253312312903e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[2.46927473e-36 4.61479299e-36 1.88480430e-01]
 [1.48895951e-37 6.53593609e-36 6.88480430e-01]
 [8.72191434e-36 0.00000000e+00 8.11519570e-01]
 [1.31083423e-35 0.00000000e+00 3.11519570e-01]
 [3.33333333e-01 6.66666667e-01 5.21516765e-01]
 [6.66666667e-01 3.33333333e-01 2.15167651e-02]
 [6.66666667e-01 3.33333333e-01 4.78483235e-01]
 [3.33333333e-01 6.66666667e-01 9.78483235e-01]
 [3.33333333e-01 6.66666667e-01 6.43538661e-01]
 [6.66666667e-01 3.33333333e-01 1.43538661e-01]
 [6.66666667e-01 3.33333333e-01 3.56461339e-01]
 [3.33333333e-01 6.66666667e-01 8.56461339e-01]]
cellpar =  Cell([[2.514490061694091, -2.3686599340229413e-19, 6.783263266132771e-37], [-1.2572450308470455, 2.177612270990583, 1.3583117519972295e-36], [-8.574163565281153e-37, -7.991688483243605e-36, 12.348598171419729]])
forces =  [[-6.19869658e-32  3.57881914e-32 -2.47753420e-09]
 [ 1.65298576e-31 -1.43152766e-31 -2.47753420e-09]
 [ 1.65298576e-31 -7.15763828e-32  2.47753420e-09]
 [-1.13642771e-31 -1.78940957e-32  2.47753420e-09]
 [-6.19869658e-31  2.14729148e-31 -2.95370950e-09]
 [-2.06623219e-31  3.57881914e-31 -2.95370950e-09]
 [-1.23973932e-31 -7.15763828e-32  2.95370950e-09]
 [-2.06623219e-31 -2.14729148e-31  2.95370950e-09]
 [-2.06623219e-31  7.15763828e-32  1.96147987e-10]
 [ 2.16954380e-31 -8.94704785e-32  1.96147987e-10]
 [ 1.34305093e-31  1.25258670e-31 -1.96147987e-10]
 [-2.37616702e-31  1.25258670e-31 -1.96147987e-10]]
stress =  [-5.51661785e-11 -5.51661785e-11 -1.32602533e-10 -1.52792132e-34
 -2.64643736e-34  7.14838065e-27]
energy per atom =  -7.356336453089162
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0