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_HiremathMelinBitzek_2022_W__MO_943864507178_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 15:36:34      -33.628954         1.017527
BFGS:    1 15:36:34      -33.667063         0.728221
BFGS:    2 15:36:34      -33.704726         0.055538
BFGS:    3 15:36:34      -33.704931         0.002707
BFGS:    4 15:36:34      -33.704932         0.000009
BFGS:    5 15:36:34      -33.704932         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 9.725031853946026e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['W', 'W', 'W', 'W']
basis =  [[0.  0.  0. ]
 [0.  0.5 0.5]
 [0.5 0.  0.5]
 [0.5 0.5 0. ]]
cellpar =  Cell([[4.011999659692983, 2.562234008396004e-33, 1.135777147936191e-33], [2.0321736619354196e-33, 4.011999659692983, 7.292032841500927e-21], [-4.718840242499756e-34, 7.292032841501694e-21, 4.011999659692983]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-9.72503185e-11 -9.72503185e-11 -9.72503185e-11 -8.21425500e-27
  1.27628432e-34  1.00777239e-50]
energy per atom =  -8.426232956777572
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0