element(s):
['Si']
AFLOW prototype label:
A_hP4_194_f
Parameter names:
['a', 'c/a', 'z1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.8496', '1.6527431', '0.56294015']
model name:
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Si']
representative atom coordinates =  [[0.33333333 0.66666667 0.56294015]]
spacegroup =  194
cell =  [[3.8496, 0, 0], [-1.9248, 3.3338513944086, 0], [0, 0, 6.3624]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 14:39:05      -18.504750         0.558796
BFGS:    1 14:39:05      -18.510316         0.272798
BFGS:    2 14:39:05      -18.512813         0.216965
BFGS:    3 14:39:05      -18.519315         0.044066
BFGS:    4 14:39:05      -18.519413         0.043392
BFGS:    5 14:39:05      -18.519774         0.054068
BFGS:    6 14:39:05      -18.519944         0.036599
BFGS:    7 14:39:05      -18.519996         0.010669
BFGS:    8 14:39:05      -18.520000         0.001414
BFGS:    9 14:39:05      -18.520000         0.000044
BFGS:   10 14:39:05      -18.520000         0.000004
BFGS:   11 14:39:05      -18.520000         0.000000
BFGS:   12 14:39:05      -18.520000         0.000000
Minimization converged after 12 steps.
Maximum force component: 8.946985652347195e-10 eV/Angstrom
Maximum stress component: 2.620695454270455e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si', 'Si', 'Si', 'Si']
basis =  [[0.33333333 0.66666667 0.5625    ]
 [0.66666666 0.33333334 0.0625    ]
 [0.66666666 0.33333334 0.4375    ]
 [0.33333333 0.66666667 0.9375    ]]
cellpar =  Cell([[3.840296916848019, 1.3767729758597058e-19, -2.9096618940711596e-37], [-1.9201484584240096, 3.3257946880654403, 1.7135535507384995e-37], [8.41300149552151e-37, -1.7101921204103756e-35, 6.271178604824899]])
forces =  [[ 1.19916129e-30  1.09316225e-31 -8.94698565e-10]
 [-3.47125637e-31  6.01239239e-31 -8.94698565e-10]
 [-1.19916129e-30 -1.09316225e-31  8.94698565e-10]
 [ 3.47125637e-31 -6.01239239e-31  8.94698565e-10]]
stress =  [-4.20368997e-12 -4.20368997e-12 -2.62069545e-11 -3.93989452e-34
 -3.41204875e-33  1.59869844e-27]
energy per atom =  -4.630000000667423
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0