element(s):
['Fe']
AFLOW prototype label:
A_tP1_123_a
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:
['2.2256', '1.0359004']
model name:
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Fe']
representative atom coordinates =  [[0 0 0]]
spacegroup =  123
cell =  [[2.2256, 0, 0], [0, 2.2256, 0], [0, 0, 2.3055]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:42:07       -3.130996         2.158228
BFGS:    1 16:42:07       -3.241414         1.044728
BFGS:    2 16:42:07       -3.282495         0.245156
BFGS:    3 16:42:07       -3.285122         0.046918
BFGS:    4 16:42:07       -3.285218         0.028970
BFGS:    5 16:42:07       -3.285233         0.021259
BFGS:    6 16:42:07       -3.285243         0.004434
BFGS:    7 16:42:07       -3.285244         0.000797
BFGS:    8 16:42:07       -3.285244         0.000048
BFGS:    9 16:42:07       -3.285244         0.000004
BFGS:   10 16:42:07       -3.285244         0.000000
BFGS:   11 16:42:07       -3.285244         0.000000
Minimization converged after 11 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 4.4449390066364444e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[2.3830863847352073, 2.560256292016631e-34, -5.333247679039343e-33], [1.890942831420395e-34, 2.3830863847352073, 1.4596236421862733e-20], [-7.753941435326977e-33, 1.465069425278668e-20, 2.3830863847626365]])
forces =  [[0. 0. 0.]]
stress =  [-4.44493901e-11 -4.44493901e-11 -2.72504265e-11 -2.18876603e-27
  3.02033973e-35  5.07965641e-51]
energy per atom =  -3.2852442089170877
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Prototype label changed during relaxation: test template prototype is A_tP1_123_a, while relaxed is A_cP1_221_a. Skipping parameter set 0.
No parameter sets in this group successfully added a property instance. Skipping this group.