element(s):
['W']
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:
['4.0614']
model name:
EAM_Dynamo_SetyawanGaoKurtz_2018_ReW__MO_680820064987_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['W']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[4.0614, 0, 0], [0, 4.0614, 0], [0, 0, 4.0614]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:36:23      -33.721842         0.046117
BFGS:    1 15:36:23      -33.721929         0.042217
BFGS:    2 15:36:23      -33.722399         0.002497
BFGS:    3 15:36:23      -33.722401         0.000154
BFGS:    4 15:36:23      -33.722401         0.000002
BFGS:    5 15:36:23      -33.722401         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 7.566712672012547e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['W', 'W', 'W', 'W']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [1.68819877e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[4.0530047721467275, 7.445895283889574e-33, 5.201928402966318e-34], [8.108804864403733e-33, 4.0530047721467275, -4.397147673266862e-20], [1.6732136737274822e-32, -4.3971476732682497e-20, 4.0530047721467275]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 7.56671267e-11  7.56671267e-11  7.56671267e-11 -1.40945579e-26
  7.81618799e-36 -1.70704136e-51]
energy per atom =  -8.430600312283541
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0