element(s):
['Al']
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:
['4.039']
model name:
EAM_Dynamo_LiuLiuBorucki_1999_AlCu__MO_020851069572_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[4.039, 0, 0], [0, 4.039, 0], [0, 0, 4.039]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:09:19      -13.439588         0.042500
BFGS:    1 15:09:19      -13.439662         0.038769
BFGS:    2 15:09:19      -13.440027         0.000357
BFGS:    3 15:09:19      -13.440027         0.000003
BFGS:    4 15:09:19      -13.440027         0.000000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.1504014947220271e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al', 'Al', 'Al']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [3.39392520e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 4.66457528e-38 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[4.032073335072834, 5.094893219434633e-34, 6.587171904120392e-34], [-1.3629015366179963e-32, 4.032073335072834, 1.3019556537895465e-21], [1.6270897957669433e-32, 1.3019556537802479e-21, 4.032073335072834]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.15040149e-11  1.15040149e-11  1.15040149e-11 -3.66757875e-27
 -9.27962120e-35  2.22311495e-50]
energy per atom =  -3.360006745728027
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0