element(s):
['Cu']
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:
['2.8755']
model name:
EAM_Dynamo_MendelevSunZhang_2019_CuZr__MO_609260676108_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cu']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[2.8755, 0, 0], [0, 2.8755, 0], [0, 0, 2.8755]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:03:25       -6.481729         0.171525
BFGS:    1 16:03:25       -6.482896         0.145805
BFGS:    2 16:03:25       -6.485218         0.047130
BFGS:    3 16:03:25       -6.485421         0.006769
BFGS:    4 16:03:25       -6.485425         0.000200
BFGS:    5 16:03:25       -6.485425         0.000001
BFGS:    6 16:03:25       -6.485425         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.1927743098905277e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cu', 'Cu']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.8947472988466005, 6.0275587115777984e-33, -1.2245941926039845e-33], [8.522738208885271e-33, 2.894747298846601, 2.156481562490934e-18], [-6.054447912988956e-34, 2.156481562490933e-18, 2.8947472988466005]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.19277431e-11 -1.19277431e-11 -1.19277431e-11 -3.84765181e-28
  7.66121969e-36  2.52259203e-52]
energy per atom =  -3.2427126263136254
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0