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:
MEAM_LAMMPS_LeeBaskesKim_2001_W__MO_227263111062_001
==== 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 00:09:20      -33.512316         1.020856
BFGS:    1 00:09:20      -33.550481         0.721629
BFGS:    2 00:09:20      -33.586374         0.054368
BFGS:    3 00:09:20      -33.586565         0.002589
BFGS:    4 00:09:20      -33.586566         0.000009
BFGS:    5 00:09:20      -33.586566         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 8.481216021207559e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['W', 'W', 'W', 'W']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 3.66127376e-40 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 3.66127376e-40]]
cellpar =  Cell([[4.013269795574422, 5.435358599542166e-34, 5.868236264630121e-38], [7.681070161509697e-34, 4.013269795574422, -2.215998523393829e-23], [-2.0355304227451512e-33, -2.2159985231890677e-23, 4.013269795574422]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-8.48121602e-11 -8.48121602e-11 -8.48121602e-11 -1.03538751e-27
  3.21360316e-35 -1.09635683e-52]
energy per atom =  -8.39664138655961
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0