element(s):
['W']
AFLOW prototype label:
A_cP8_223_ac
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.1104']
model name:
EAM_MagneticCubic_DerletNguyenDudarev_2007_W__MO_195478838873_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['W', 'W']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.25 0.   0.5 ]]
spacegroup =  223
cell =  [[5.1104, 0, 0], [0, 5.1104, 0], [0, 0, 5.1104]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:27:38      -68.159136        2.3553
BFGS:    1 14:27:38      -68.349460        1.4342
BFGS:    2 14:27:38      -68.475716        0.2935
BFGS:    3 14:27:38      -68.482127        0.0413
BFGS:    4 14:27:38      -68.482262        0.0015
BFGS:    5 14:27:38      -68.482263        0.0000
BFGS:    6 14:27:38      -68.482263        0.0000
Minimization converged after 6 steps.
Maximum force component: 2.4885350575875277e-31 eV/Angstrom
Maximum stress component: 1.0195694696935806e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['W', 'W', 'W', 'W', 'W', 'W', 'W', 'W']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [2.50000000e-01 0.00000000e+00 5.00000000e-01]
 [7.50000000e-01 1.90786296e-35 5.00000000e-01]
 [5.00000000e-01 2.50000000e-01 9.53931482e-36]
 [5.00000000e-01 7.50000000e-01 0.00000000e+00]
 [1.35561817e-49 5.00000000e-01 2.50000000e-01]
 [0.00000000e+00 5.00000000e-01 7.50000000e-01]]
cellpar =  Cell([[5.047348735103713, 8.765239229576631e-33, -2.1728753968863893e-33], [1.1604987139520226e-32, 5.047348735103713, 1.1366530276862363e-18], [-6.197977791000908e-33, 1.1366530276862397e-18, 5.047348735103713]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 1.20826998e-64  4.14755843e-32 -2.07377921e-32]
 [ 2.54653248e-65 -4.67011009e-51 -2.07377921e-32]
 [-1.03688961e-32  8.29511686e-32  4.14755843e-32]
 [-8.29511686e-32 -8.29511686e-32 -1.86804403e-50]
 [ 2.07377921e-32 -2.07377921e-32 -2.48853506e-31]
 [-4.24785990e-64 -5.18444804e-32  2.48853506e-31]]
stress =  [ 1.01956947e-10  1.01956947e-10  1.01956947e-10 -8.60858992e-27
  4.83831160e-34 -7.04549452e-51]
energy per atom =  -8.560282831913668
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0
 Potential info: W potential
 Atomic number:           74
 Potential info: W potential
 Atomic number:           74
 Potential info: W potential
 Atomic number:           74
 Potential info: W potential
 Atomic number:           74
 Potential info: W potential
 Atomic number:           74
 Potential info: W potential
 Atomic number:           74
 Potential info: W potential
 Atomic number:           74
 Potential info: W potential
 Atomic number:           74
 Potential info: W potential
 Atomic number:           74