element(s):
['Ge']
AFLOW prototype label:
A_hP2_194_c
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.96', '1.708277']
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 0.25      ]]
spacegroup =  194
cell =  [[2.96, 0, 0], [-1.48, 2.5634351952019, 0], [0, 0, 5.0565]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:56:47       -8.436004        2.6511
BFGS:    1 14:56:47       -8.630975        2.5217
BFGS:    2 14:56:47       -8.888738        2.3948
BFGS:    3 14:56:47       -9.106637        1.4435
BFGS:    4 14:56:47       -9.203217        0.7606
BFGS:    5 14:56:47       -9.211308        0.5921
BFGS:    6 14:56:47       -9.215198        0.4549
BFGS:    7 14:56:47       -9.221337        0.2218
BFGS:    8 14:56:47       -9.224095        0.1252
BFGS:    9 14:56:47       -9.224783        0.0226
BFGS:   10 14:56:47       -9.224818        0.0027
BFGS:   11 14:56:47       -9.224818        0.0001
BFGS:   12 14:56:47       -9.224818        0.0000
BFGS:   13 14:56:47       -9.224818        0.0000
BFGS:   14 14:56:47       -9.224818        0.0000
Minimization converged after 14 steps.
Maximum force component: 2.0006694668431347e-32 eV/Angstrom
Maximum stress component: 7.378262070739545e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ge', 'Ge']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[3.246271808642549, -4.377953356436412e-17, -2.272514267014411e-37], [-1.6231359043212745, 2.811353853873703, -1.1280880921152213e-36], [-4.8416690947601974e-36, -5.015052587557031e-36, 5.300868663463323]])
forces =  [[-2.00066947e-32  1.15508706e-32 -3.70122306e-69]
 [ 2.00066947e-32 -1.15508706e-32  3.70122306e-69]]
stress =  [-7.37826207e-12 -7.37826207e-12 -5.84119245e-12  1.37849963e-34
 -3.24275694e-47  1.04548906e-27]
energy per atom =  0.08009046565475053
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0