element(s):
['Mg']
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:
['3.1895', '1.6237655']
model name:
MEAM_LAMMPS_KimKimLee_2009_AlMg__MO_058537087384_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Mg']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[3.1895, 0, 0], [-1.59475, 2.7621880253705, 0], [0, 0, 5.179]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 14:02:40       -3.097327         0.091167
BFGS:    1 14:02:40       -3.097623         0.080712
BFGS:    2 14:02:40       -3.098674         0.005391
BFGS:    3 14:02:40       -3.098676         0.007004
BFGS:    4 14:02:40       -3.098678         0.007355
BFGS:    5 14:02:40       -3.098682         0.006272
BFGS:    6 14:02:40       -3.098684         0.003386
BFGS:    7 14:02:40       -3.098686         0.000883
BFGS:    8 14:02:40       -3.098686         0.000159
BFGS:    9 14:02:40       -3.098686         0.000015
BFGS:   10 14:02:40       -3.098686         0.000001
BFGS:   11 14:02:40       -3.098686         0.000000
BFGS:   12 14:02:40       -3.098686         0.000000
Minimization converged after 12 steps.
Maximum force component: 1.483304237847476e-32 eV/Angstrom
Maximum stress component: 1.0681969184502096e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Mg', 'Mg']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[3.2090649726778526, 1.3413246797010204e-18, 2.4491842021774473e-38], [-1.6045324863389263, 2.779131788733836, 7.331616006508989e-38], [-1.247156352877511e-37, -1.0928796516435264e-36, 5.196910589971892]])
forces =  [[-1.48330424e-32  8.56386101e-33  1.06761448e-32]
 [ 1.48330424e-32 -8.56386101e-33 -1.06761448e-32]]
stress =  [-1.06819692e-11 -1.06819692e-11 -7.42290527e-13 -2.48916033e-34
 -6.15907451e-35 -9.95158347e-28]
energy per atom =  -1.5493428501565654
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0