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 17:01:04      -34.164156       15.3181
BFGS:    1 17:01:04      -36.539623       16.3628
BFGS:    2 17:01:04      -39.075254       17.4526
BFGS:    3 17:01:04      -41.777291       18.5800
BFGS:    4 17:01:04      -44.650556       19.7334
BFGS:    5 17:01:04      -47.708350       21.0031
BFGS:    6 17:01:04      -50.946121       22.1627
BFGS:    7 17:01:04      -54.354928       23.2774
BFGS:    8 17:01:04      -57.924950       24.3038
BFGS:    9 17:01:04      -61.647503       25.2593
BFGS:   10 17:01:04      -65.489426       25.9210
BFGS:   11 17:01:04      -69.407416       26.2536
BFGS:   12 17:01:05      -73.347393       26.1964
BFGS:   13 17:01:05      -77.228099       25.4201
BFGS:   14 17:01:05      -80.929040       23.7537
BFGS:   15 17:01:05      -84.300430       20.9614
BFGS:   16 17:01:05      -87.131235       16.4705
BFGS:   17 17:01:05      -89.133028        9.8028
BFGS:   18 17:01:05      -89.964289        0.4996
BFGS:   19 17:01:05      -89.965856        0.1123
BFGS:   20 17:01:05      -89.965938        0.0008
BFGS:   21 17:01:05      -89.965939        0.0000
BFGS:   22 17:01:05      -89.965939        0.0000
Minimization converged after 22 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.4717970724514824e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ge', 'Ge', 'Ge', 'Ge']
basis =  [[0.  0.  0. ]
 [0.  0.5 0.5]
 [0.5 0.  0.5]
 [0.5 0.5 0. ]]
cellpar =  Cell([[3.3006329995722683, 1.1592861291346656e-32, -3.26510646243078e-33], [1.1612292066009183e-32, 3.3006329995722683, 7.482105499100715e-19], [2.140199974212722e-33, 7.482105499100579e-19, 3.3006329995722683]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.47179707e-12 -1.47179707e-12 -1.47179707e-12  2.97251185e-30
 -5.65712779e-33  1.35814310e-50]
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