element(s):
['Au', 'Cu']
AFLOW prototype label:
A3B_cP4_221_c_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.047']
model name:
EAM_Dynamo_ZhouJohnsonWadley_2004_CuAgAuNiPdPtAlPbFeMoTaWMgCoTiZr__MO_870117231765_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Au', 'Cu']
representative atom coordinates =  [[0.  0.5 0.5]
 [0.  0.  0. ]]
spacegroup =  221
cell =  [[4.047, 0, 0], [0, 4.047, 0], [0, 0, 4.047]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 14:52:54      -15.624535         0.789395
BFGS:    1 14:52:54      -15.649267         0.672048
BFGS:    2 14:52:54      -15.708711         0.109948
BFGS:    3 14:52:54      -15.710228         0.006819
BFGS:    4 14:52:54      -15.710234         0.000051
BFGS:    5 14:52:54      -15.710234         0.000000
BFGS:    6 14:52:54      -15.710234         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 4.196766604114361e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Au', 'Au', 'Au', 'Cu']
basis =  [[8.60516336e-50 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [0.00000000e+00 0.00000000e+00 0.00000000e+00]]
cellpar =  Cell([[3.97568144185094, 7.030359058913538e-33, 5.8287783580324955e-33], [9.026033688714785e-34, 3.97568144185094, -3.576112048491539e-19], [-2.7984414584051626e-33, -3.5761120484915265e-19, 3.97568144185094]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-4.19676660e-15 -4.19676660e-15 -4.19676660e-15 -2.78046198e-31
  0.00000000e+00  4.00594264e-64]
energy per atom =  -3.9275584703976656
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0