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:
MEAM_LAMMPS_KimShinLee_2008_Ge__MO_657096500078_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 09:26:06      -15.263220         1.260348
BFGS:    1 09:26:06      -15.327828         0.545289
BFGS:    2 09:26:06      -15.339625         0.442232
BFGS:    3 09:26:06      -15.356901         0.204124
BFGS:    4 09:26:06      -15.361864         0.190104
BFGS:    5 09:26:06      -15.364241         0.101684
BFGS:    6 09:26:06      -15.365098         0.078242
BFGS:    7 09:26:07      -15.365278         0.060009
BFGS:    8 09:26:07      -15.365372         0.040371
BFGS:    9 09:26:07      -15.365458         0.012517
BFGS:   10 09:26:07      -15.365477         0.003038
BFGS:   11 09:26:07      -15.365478         0.000452
BFGS:   12 09:26:07      -15.365478         0.000046
BFGS:   13 09:26:07      -15.365478         0.000002
BFGS:   14 09:26:07      -15.365478         0.000000
BFGS:   15 09:26:07      -15.365478         0.000000
Minimization converged after 15 steps.
Maximum force component: 1.640216271830975e-09 eV/Angstrom
Maximum stress component: 1.1686741292688344e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ge', 'Ge', 'Ge', 'Ge']
basis =  [[0.33333333 0.66666667 0.06605049]
 [0.66666666 0.33333334 0.56605049]
 [0.66666666 0.33333334 0.93394951]
 [0.33333333 0.66666667 0.43394951]]
cellpar =  Cell([[3.9674834143818587, 8.314147502431789e-18, -8.971257837766359e-38], [-1.9837417071909293, 3.435941425948113, 5.437020723660378e-37], [5.116574439609869e-37, -1.1323552706761446e-36, 6.6412687119462745]])
forces =  [[-1.26380577e-46  5.64683305e-32 -1.64021627e-09]
 [ 1.30408023e-31  2.79934835e-46 -1.64021627e-09]
 [ 1.26380577e-46 -5.64683305e-32  1.64021627e-09]
 [-1.30408023e-31 -2.79934835e-46  1.64021627e-09]]
stress =  [3.45270475e-11 3.45270475e-11 1.16867413e-10 1.62048461e-33
 3.11862408e-34 6.05293709e-27]
energy per atom =  -3.8413695907031733
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0