element(s):
['Zr']
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:
['3.5751']
model name:
EAM_Dynamo_MendelevAckland_2007_Zr__MO_537826574817_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Zr']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[3.5751, 0, 0], [0, 3.5751, 0], [0, 0, 3.5751]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 18:15:01      -13.063445        0.0079
BFGS:    1 18:15:01      -13.063447        0.0060
BFGS:    2 18:15:01      -13.063450        0.0001
BFGS:    3 18:15:01      -13.063450        0.0000
BFGS:    4 18:15:01      -13.063450        0.0000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 4.813997926619831e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Zr', 'Zr']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.5759294161429964, -2.407052905111859e-33, 1.7196128805001602e-33], [-2.829395819884833e-32, 3.5759294161429964, 1.362622189965536e-19], [-9.506824615608775e-33, 1.362622189965684e-19, 3.5759294161429964]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 4.81399793e-14  4.81399793e-14  4.81399793e-14 -5.95064768e-31
 -2.00817403e-35 -3.57649512e-52]
energy per atom =  -6.531725117202028
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0