element(s):
['Fe']
AFLOW prototype label:
A_hP2_194_c
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.4403', '1.5759538']
model name:
EAM_Dynamo_MendelevHanSrolovitz_2003_Fe__MO_807997826449_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Fe']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[2.4403, 0, 0], [-1.22015, 2.1133617928552, 0], [0, 0, 3.8458]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 13:56:43       -7.672816         2.077953
BFGS:    1 13:56:43       -7.776809         1.754117
BFGS:    2 13:56:43       -7.912172         1.133849
BFGS:    3 13:56:43       -7.986661         0.460970
BFGS:    4 13:56:43       -8.006759         0.110172
BFGS:    5 13:56:43       -8.008967         0.039314
BFGS:    6 13:56:43       -8.009209         0.016348
BFGS:    7 13:56:43       -8.009225         0.017510
BFGS:    8 13:56:43       -8.009242         0.021009
BFGS:    9 13:56:43       -8.009294         0.027199
BFGS:   10 13:56:43       -8.009414         0.033899
BFGS:   11 13:56:43       -8.009631         0.041647
BFGS:   12 13:56:43       -8.009765         0.026950
BFGS:   13 13:56:43       -8.009854         0.000912
BFGS:   14 13:56:43       -8.009854         0.000130
BFGS:   15 13:56:43       -8.009854         0.000005
BFGS:   16 13:56:43       -8.009854         0.000000
BFGS:   17 13:56:43       -8.009854         0.000000
Minimization converged after 17 steps.
Maximum force component: 6.812593542736638e-32 eV/Angstrom
Maximum stress component: 3.8367894187844133e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Fe']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[2.6206406872587023, -6.930637112393506e-18, -7.644824133361993e-36], [-1.3103203436293511, 2.2695414093571458, 2.750449295642135e-36], [4.3414698353406896e-37, -2.7517207559723614e-36, 4.145274380909308]])
forces =  [[-6.72956050e-33  2.33118814e-33  6.81259354e-32]
 [ 6.72956050e-33 -2.33118814e-33 -6.81259354e-32]]
stress =  [2.69917090e-12 2.69917090e-12 3.83678942e-11 5.45905946e-35
 2.83661050e-34 7.99196684e-28]
energy per atom =  -4.004927028252892
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0