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_AhmadGrohGhazisaeidi_2018_MgY__MO_135739722270_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       -3.018943         0.018269
BFGS:    1 14:02:40       -3.018954         0.016350
BFGS:    2 14:02:41       -3.018994         0.000780
BFGS:    3 14:02:41       -3.018994         0.000824
BFGS:    4 14:02:41       -3.018994         0.000723
BFGS:    5 14:02:41       -3.018994         0.000373
BFGS:    6 14:02:41       -3.018994         0.000065
BFGS:    7 14:02:41       -3.018994         0.000010
BFGS:    8 14:02:41       -3.018994         0.000001
BFGS:    9 14:02:41       -3.018994         0.000000
BFGS:   10 14:02:41       -3.018994         0.000000
Minimization converged after 10 steps.
Maximum force component: 9.212638970925775e-33 eV/Angstrom
Maximum stress component: 1.830310498200388e-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([[3.1866241704200933, 6.169880975559455e-19, -7.579646986924156e-40], [-1.5933120852100466, 2.7596974838973134, -1.313159877227496e-42], [2.4557750821412643e-39, 4.3383252951888646e-39, 5.1722369090107]])
forces =  [[ 6.95551023e-33 -6.37798083e-33 -7.75518154e-73]
 [-8.59210088e-33  9.21263897e-33  7.74169325e-73]]
stress =  [-1.73201813e-11 -1.73201813e-11 -1.83031050e-11  2.92343001e-35
  1.94751127e-35  3.26686175e-27]
energy per atom =  -1.5094971763190712
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0