element(s):
['Si']
AFLOW prototype label:
A_cI12_229_d
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['6.7307']
model name:
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Si']
representative atom coordinates =  [[0.25 0.   0.5 ]]
spacegroup =  229
cell =  [[6.7307, 0, 0], [0, 6.7307, 0], [0, 0, 6.7307]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:16:32      -48.214282         0.405501
BFGS:    1 15:16:32      -48.221180         0.388360
BFGS:    2 15:16:32      -48.268168         0.237181
BFGS:    3 15:16:32      -48.292042         0.080167
BFGS:    4 15:16:32      -48.295035         0.002271
BFGS:    5 15:16:32      -48.295038         0.000021
BFGS:    6 15:16:32      -48.295038         0.000000
Minimization converged after 6 steps.
Maximum force component: 9.60092730017688e-30 eV/Angstrom
Maximum stress component: 2.1225308965157553e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si']
basis =  [[2.50000000e-01 0.00000000e+00 5.00000000e-01]
 [7.50000000e-01 7.31904044e-33 5.00000000e-01]
 [5.00000000e-01 2.50000000e-01 0.00000000e+00]
 [5.00000000e-01 7.50000000e-01 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 2.50000000e-01]
 [1.29794168e-37 5.00000000e-01 7.50000000e-01]
 [0.00000000e+00 2.50000000e-01 5.00000000e-01]
 [0.00000000e+00 7.50000000e-01 5.00000000e-01]
 [2.50000000e-01 5.00000000e-01 0.00000000e+00]
 [7.50000000e-01 5.00000000e-01 0.00000000e+00]
 [5.00000000e-01 3.64505572e-33 7.50000000e-01]
 [5.00000000e-01 3.61612670e-33 2.50000000e-01]]
cellpar =  Cell([[6.657433848788686, -3.709600817359554e-34, -1.2089796014054883e-33], [-6.1151808052011274e-33, 6.657433848788686, 2.3491097913075164e-18], [3.316977304611666e-33, 2.3491097913074143e-18, 6.657433848788686]])
forces =  [[-2.73530692e-32  6.83826731e-33 -4.10296038e-32]
 [-4.37649108e-31  6.83826731e-33 -1.36765346e-32]
 [-4.10296038e-32  2.46177623e-30  3.41913365e-33]
 [-1.36765346e-32 -3.17295603e-30  3.41913365e-33]
 [ 3.41913365e-33 -2.73530692e-32 -1.09412277e-30]
 [ 3.41913365e-33  8.87953753e-49  2.51648237e-30]
 [-1.88052351e-32  7.38532869e-30  2.60595123e-48]
 [-4.27391707e-32 -7.76827166e-30 -2.74107463e-48]
 [ 4.10296038e-31 -2.41291781e-51 -6.83826731e-33]
 [-2.04424509e-65 -1.44775068e-50 -4.10296038e-32]
 [ 4.60423415e-63 -2.73530692e-32  9.19063126e-30]
 [-4.78981480e-63  6.83826731e-33 -9.60092730e-30]]
stress =  [ 2.12253090e-10  2.12253090e-10  2.12253090e-10 -3.62451801e-26
 -9.27012276e-35  1.05135962e-50]
energy per atom =  -4.024586459407344
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0