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_DuLenoskyHennig_2011_Si__MO_883726743759_001
==== 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 11:00:31      -18.533353         0.381134
BFGS:    1 11:00:31      -18.536208         0.320292
BFGS:    2 11:00:31      -18.542759         0.067489
BFGS:    3 11:00:31      -18.542998         0.045915
BFGS:    4 11:00:32      -18.543189         0.007095
BFGS:    5 11:00:32      -18.543191         0.006696
BFGS:    6 11:00:32      -18.543205         0.000671
BFGS:    7 11:00:32      -18.543205         0.000090
BFGS:    8 11:00:32      -18.543205         0.000000
BFGS:    9 11:00:32      -18.543205         0.000000
Minimization converged after 9 steps.
Maximum force component: 5.770459867045479e-10 eV/Angstrom
Maximum stress component: 1.6931122705511277e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si', 'Si', 'Si', 'Si']
basis =  [[0.33333333 0.66666667 0.56321244]
 [0.66666666 0.33333334 0.06321244]
 [0.66666666 0.33333334 0.43678756]
 [0.33333333 0.66666667 0.93678756]]
cellpar =  Cell([[3.834901227194112, 9.974288976090158e-19, -2.1803682766269737e-38], [-1.917450613597056, 3.32112188375422, -1.998197123752941e-37], [-2.2531970868792253e-36, 9.14838136379444e-36, 6.30294421075954]])
forces =  [[ 8.86290133e-32 -9.89286370e-32  5.77045987e-10]
 [-2.06284284e-46  8.37550925e-46  5.77045987e-10]
 [ 3.74211389e-32 -1.19396631e-31 -5.77045987e-10]
 [ 2.06284284e-46 -8.37550925e-46 -5.77045987e-10]]
stress =  [ 4.54309301e-11  4.54309301e-11 -1.69311227e-10  5.20135866e-33
 -5.09944385e-34 -1.27528418e-26]
energy per atom =  -4.63580125093682
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0