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:
Sim_LAMMPS_MEAM_Lenosky_2017_W__SM_631352869360_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 15:22:47      -33.896328         1.314936
BFGS:    1 15:22:47      -33.954277         0.734019
BFGS:    2 15:22:47      -33.978307         0.075093
BFGS:    3 15:22:47      -33.978540         0.004266
BFGS:    4 15:22:47      -33.978541         0.000025
BFGS:    5 15:22:47      -33.978541         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 4.906064889615305e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['W', 'W', 'W', 'W']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [1.66784857e-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([[4.102457357886207, 2.5026688203974363e-33, 4.311965314311638e-33], [-3.5028549281228825e-33, 4.102457357886207, -4.814596341553796e-19], [-3.450973690241592e-33, -4.814596341553707e-19, 4.102457357886207]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 4.90606489e-10  4.90606489e-10  4.90606489e-10  6.85861797e-26
 -1.22062162e-34 -8.27963572e-51]
energy per atom =  -8.494635222645684
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0