element(s):
['Ge']
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:
['4.0447', '1.6504562', '0.56285163']
model name:
SNAP_ZuoChenLi_2019_Ge__MO_183216355174_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ge']
representative atom coordinates =  [[0.33333333 0.66666667 0.06285163]]
spacegroup =  194
cell =  [[4.0447, 0, 0], [-2.02235, 3.5028129506869, 0], [0, 0, 6.6756]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:33:15      -17.353475         1.981127
BFGS:    1 15:33:15      -17.431539         1.573179
BFGS:    2 15:33:15      -17.532101         0.884262
BFGS:    3 15:33:15      -17.585506         0.285427
BFGS:    4 15:33:15      -17.596485         0.099747
BFGS:    5 15:33:15      -17.597376         0.074818
BFGS:    6 15:33:15      -17.598253         0.080998
BFGS:    7 15:33:15      -17.598655         0.051053
BFGS:    8 15:33:15      -17.598752         0.023958
BFGS:    9 15:33:15      -17.598780         0.014019
BFGS:   10 15:33:15      -17.598835         0.020505
BFGS:   11 15:33:15      -17.598953         0.028349
BFGS:   12 15:33:15      -17.599181         0.033964
BFGS:   13 15:33:15      -17.599467         0.038182
BFGS:   14 15:33:15      -17.599631         0.019679
BFGS:   15 15:33:15      -17.599663         0.003790
BFGS:   16 15:33:15      -17.599665         0.000154
BFGS:   17 15:33:15      -17.599665         0.000021
BFGS:   18 15:33:15      -17.599665         0.000002
BFGS:   19 15:33:15      -17.599665         0.000000
BFGS:   20 15:33:15      -17.599665         0.000000
Minimization converged after 20 steps.
Maximum force component: 1.3242389131865736e-09 eV/Angstrom
Maximum stress component: 2.0573491744458129e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ge', 'Ge', 'Ge', 'Ge']
basis =  [[0.33333333 0.66666667 0.06076067]
 [0.66666666 0.33333334 0.56076067]
 [0.66666666 0.33333334 0.93923933]
 [0.33333333 0.66666667 0.43923933]]
cellpar =  Cell([[4.170487877936934, -5.563408408875499e-18, 5.33207858775699e-37], [-2.085243938968467, 3.6117484484684397, 5.620175404400245e-37], [2.480338553500682e-36, -3.2252514724671367e-35, 6.882972090902219]])
forces =  [[-7.28240785e-32  6.67773551e-32  1.32423891e-09]
 [ 1.37080618e-31 -6.20535622e-45  1.32423891e-09]
 [ 7.28240785e-32 -6.67773551e-32 -1.32423891e-09]
 [-1.37080618e-31  6.20535622e-45 -1.32423891e-09]]
stress =  [-2.05734917e-10 -2.05734917e-10 -1.32681575e-10  8.26372214e-35
  1.43131866e-34  3.79670048e-26]
energy per atom =  0.2925829975196841
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0