element(s):
['Au', 'Cu']
AFLOW prototype label:
AB3_cP4_221_a_c
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.7854']
model name:
EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_CuAgAu__MO_318213562153_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Au', 'Cu']
representative atom coordinates =  [[0.  0.  0. ]
 [0.  0.5 0.5]]
spacegroup =  221
cell =  [[3.7854, 0, 0], [0, 3.7854, 0], [0, 0, 3.7854]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:06:02      -14.909354         0.246533
BFGS:    1 16:06:02      -14.911835         0.223050
BFGS:    2 16:06:02      -14.923099         0.002097
BFGS:    3 16:06:02      -14.923100         0.000021
BFGS:    4 16:06:02      -14.923100         0.000000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.5089551214106626e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Au', 'Cu', 'Cu', 'Cu']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [9.12277912e-50 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.25382522e-38]]
cellpar =  Cell([[3.7501059517003643, 3.2868249674277437e-33, -4.4016618465381296e-33], [4.3824375995862826e-33, 3.7501059517003643, -8.082328001077197e-22], [8.153952205579927e-33, -8.082328001142936e-22, 3.7501059517003643]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.50895512e-10  1.50895512e-10  1.50895512e-10  1.71489833e-26
 -1.46077098e-34 -2.11670251e-50]
energy per atom =  -3.73077489641743
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0