element(s):
['Mg', 'Y']
AFLOW prototype label:
AB_cP2_221_a_b
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.8003']
model name:
MEAM_LAMMPS_AhmadGrohGhazisaeidi_2018_MgY__MO_135739722270_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Mg', 'Y']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  221
cell =  [[3.8003, 0, 0], [0, 3.8003, 0], [0, 0, 3.8003]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 13:02:54       -6.143415         0.202616
BFGS:    1 13:02:54       -6.145055         0.175013
BFGS:    2 13:02:54       -6.149702         0.008757
BFGS:    3 13:02:54       -6.149713         0.000351
BFGS:    4 13:02:54       -6.149713         0.000001
BFGS:    5 13:02:54       -6.149713         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.870019407429364e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Mg', 'Y']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.76152507347147, -6.28831061869811e-33, 7.06362810915866e-33], [-5.3670934151359005e-33, 3.76152507347147, 2.0562223035528238e-19], [-1.0996868082526946e-32, 2.056222303552945e-19, 3.76152507347147]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.87001941e-12 -1.87001941e-12 -1.87001941e-12 -1.92897841e-28
 -3.62978829e-35 -2.22707148e-51]
energy per atom =  -3.0748567270698253
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0