element(s):
['Pb']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.0157']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Pb']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[5.0157, 0, 0], [0, 5.0157, 0], [0, 0, 5.0157]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:35:18      -12.947003         5.580037
BFGS:    1 16:35:18      -13.809459         5.920567
BFGS:    2 16:35:18      -14.724541         6.297551
BFGS:    3 16:35:18      -15.695302         6.645294
BFGS:    4 16:35:18      -16.717730         6.984961
BFGS:    5 16:35:18      -17.789871         7.306142
BFGS:    6 16:35:18      -18.908694         7.617033
BFGS:    7 16:35:18      -20.070018         7.856989
BFGS:    8 16:35:18      -21.262041         8.021680
BFGS:    9 16:35:18      -22.471164         8.078872
BFGS:   10 16:35:18      -23.680965         8.010842
BFGS:   11 16:35:18      -24.863426         7.715740
BFGS:   12 16:35:19      -25.981867         7.143521
BFGS:   13 16:35:19      -26.990761         6.225476
BFGS:   14 16:35:19      -27.823992         4.789757
BFGS:   15 16:35:19      -28.396097         2.773466
BFGS:   16 16:35:19      -28.603322         0.175361
BFGS:   17 16:35:19      -28.603973         0.028816
BFGS:   18 16:35:19      -28.603991         0.000241
BFGS:   19 16:35:19      -28.603991         0.000000
BFGS:   20 16:35:19      -28.603991         0.000000
Minimization converged after 20 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.9202755110395958e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Pb', 'Pb', 'Pb', 'Pb']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [5.11157146e-48 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[4.015757800046606, -1.4788659160024236e-32, -3.3139154959370756e-32], [-1.306234360982681e-32, 4.015757800046606, 1.187165751301008e-16], [-2.970465459012894e-32, 1.1871657513010085e-16, 4.015757800046606]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.92027551e-13  1.92027551e-13  1.92027551e-13  6.51727578e-29
 -1.14650696e-33 -4.23461394e-49]
energy per atom =  -7.150997744971751
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0