element(s):
['Ge']
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:
['4.2619']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ge']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[4.2619, 0, 0], [0, 4.2619, 0], [0, 0, 4.2619]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:20:50      -34.164156        15.318098
BFGS:    1 15:20:50      -36.539623        16.362787
BFGS:    2 15:20:50      -39.075254        17.452618
BFGS:    3 15:20:50      -41.777291        18.579973
BFGS:    4 15:20:50      -44.650556        19.733372
BFGS:    5 15:20:50      -47.708350        21.003129
BFGS:    6 15:20:50      -50.946121        22.162664
BFGS:    7 15:20:50      -54.354928        23.277406
BFGS:    8 15:20:50      -57.924950        24.303788
BFGS:    9 15:20:50      -61.647503        25.259349
BFGS:   10 15:20:50      -65.489426        25.921034
BFGS:   11 15:20:50      -69.407416        26.253646
BFGS:   12 15:20:50      -73.347393        26.196417
BFGS:   13 15:20:50      -77.228099        25.420082
BFGS:   14 15:20:50      -80.929040        23.753664
BFGS:   15 15:20:50      -84.300430        20.961423
BFGS:   16 15:20:51      -87.131235        16.470473
BFGS:   17 15:20:51      -89.133028         9.802812
BFGS:   18 15:20:51      -89.964289         0.499579
BFGS:   19 15:20:51      -89.965856         0.112331
BFGS:   20 15:20:51      -89.965938         0.000837
BFGS:   21 15:20:51      -89.965939         0.000001
BFGS:   22 15:20:51      -89.965939         0.000000
Minimization converged after 22 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.4960006689089013e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ge', 'Ge', 'Ge', 'Ge']
basis =  [[0.0000000e+00 0.0000000e+00 0.0000000e+00]
 [0.0000000e+00 5.0000000e-01 5.0000000e-01]
 [5.0000000e-01 7.0020385e-34 5.0000000e-01]
 [5.0000000e-01 5.0000000e-01 0.0000000e+00]]
cellpar =  Cell([[3.300632999572267, -2.890561678679645e-33, -1.5237097225742885e-34], [-2.4745318182869357e-32, 3.3006329995722674, -6.209170506070775e-18], [-1.7877824001640323e-34, -6.209170506070776e-18, 3.300632999572267]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.49600067e-12 -1.49600067e-12 -1.49600067e-12 -2.46745760e-30
  1.57928151e-33 -7.42869765e-51]
energy per atom =  -22.491484625223247
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0