element(s):
['Cr']
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:
['2.8741']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cr']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[2.8741, 0, 0], [0, 2.8741, 0], [0, 0, 2.8741]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:46:56      -19.306174       32.9803
BFGS:    1 17:46:56      -22.846812       15.5162
BFGS:    2 17:46:56      -24.196298        5.4319
BFGS:    3 17:46:56      -24.440938        1.5227
BFGS:    4 17:46:56      -24.464971        0.2162
BFGS:    5 17:46:56      -24.465496        0.0113
BFGS:    6 17:46:56      -24.465498        0.0001
BFGS:    7 17:46:56      -24.465498        0.0000
BFGS:    8 17:46:56      -24.465498        0.0000
Minimization converged after 8 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 4.723565744703314e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cr', 'Cr']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.0599102205464, -1.346111863400802e-32, 2.592032706505507e-33], [-2.1355064936558834e-33, 3.0599102205464, -2.734715448338619e-18], [4.496309573338136e-33, -2.73471544833862e-18, 3.0599102205464]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-4.72356574e-15 -4.72356574e-15 -4.72356574e-15 -2.51920335e-31
 -8.77630751e-34 -2.95329417e-50]
energy per atom =  -12.232748918300748
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0