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_MagneticCubic_MendelevHanSrolovitz_2003_Fe__MO_856295952425_002
==== 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 14:56:11       -7.672816         2.077954
BFGS:    1 14:56:11       -7.776809         1.754114
BFGS:    2 14:56:11       -7.912172         1.133850
BFGS:    3 14:56:11       -7.986661         0.460966
BFGS:    4 14:56:11       -8.006759         0.110175
BFGS:    5 14:56:11       -8.008967         0.039317
BFGS:    6 14:56:11       -8.009209         0.016345
BFGS:    7 14:56:11       -8.009225         0.017505
BFGS:    8 14:56:11       -8.009242         0.021011
BFGS:    9 14:56:11       -8.009294         0.027204
BFGS:   10 14:56:11       -8.009414         0.033905
BFGS:   11 14:56:11       -8.009631         0.041660
BFGS:   12 14:56:11       -8.009765         0.026959
BFGS:   13 14:56:11       -8.009854         0.000773
BFGS:   14 14:56:11       -8.009854         0.000120
BFGS:   15 14:56:11       -8.009854         0.000004
BFGS:   16 14:56:11       -8.009854         0.000000
Minimization converged after 16 steps.
Maximum force component: 4.1723208348455024e-32 eV/Angstrom
Maximum stress component: 6.185520389336103e-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([[2.6206364955928683, -3.959015597366795e-18, 2.0097319538693673e-36], [-1.3103182477964341, 2.2695377792680502, -5.428935245021725e-37], [-3.970999814613965e-37, 6.446391369097315e-36, 4.145280365359307]])
forces =  [[ 4.17232083e-32 -3.49677662e-32  2.48791718e-68]
 [-4.17232083e-32  3.49677662e-32 -2.48791718e-68]]
stress =  [-4.43450333e-11 -4.43450333e-11  6.18552039e-11 -1.09181206e-33
 -1.03877321e-47  4.49429679e-27]
energy per atom =  -4.004927029535899
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0
 Potential info: Fe Mendelev potential
 Atomic number:           26
 Potential info: Fe Mendelev potential
 Atomic number:           26
 Potential info: Fe Mendelev potential
 Atomic number:           26