element(s):
['W']
AFLOW prototype label:
A_cI2_229_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.2041']
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 =  229
cell =  [[3.2041, 0, 0], [0, 3.2041, 0], [0, 0, 3.2041]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:26:53      -17.278885         1.063284
BFGS:    1 16:26:53      -17.312981         0.423863
BFGS:    2 16:26:53      -17.318972         0.031478
BFGS:    3 16:26:53      -17.319004         0.000836
BFGS:    4 16:26:53      -17.319004         0.000002
BFGS:    5 16:26:53      -17.319004         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 4.998466318496483e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['W', 'W']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.1647203282050516, 4.554044166564552e-33, 1.8474483969878269e-34], [6.340359620859389e-33, 3.164720328205051, 2.5735995716824037e-19], [1.4536513495822138e-33, 2.5735995716823507e-19, 3.1647203282050516]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-4.99846632e-12 -4.99846632e-12 -4.99846632e-12 -5.89379247e-28
 -8.20462105e-34 -8.41292242e-50]
energy per atom =  -8.65950216608053
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0