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:
EAM_Dynamo_LiuOhotnickyAdams_1997_AlMg__MO_559870613549_000
==== 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 15:50:37       -3.019834         0.030472
BFGS:    1 15:50:37       -3.019870         0.027138
BFGS:    2 15:50:37       -3.020002         0.001458
BFGS:    3 15:50:37       -3.020002         0.001242
BFGS:    4 15:50:37       -3.020002         0.000779
BFGS:    5 15:50:37       -3.020002         0.000641
BFGS:    6 15:50:37       -3.020002         0.000245
BFGS:    7 15:50:37       -3.020002         0.000068
BFGS:    8 15:50:37       -3.020002         0.000007
BFGS:    9 15:50:37       -3.020002         0.000000
BFGS:   10 15:50:37       -3.020002         0.000000
BFGS:   11 15:50:37       -3.020002         0.000000
Minimization converged after 11 steps.
Maximum force component: 2.131202598107192e-32 eV/Angstrom
Maximum stress component: 2.049876452213307e-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([[3.1959999971371946, -2.197973273835193e-18, 1.499915674830512e-39], [-1.5979999985685973, 2.767817188015804, 4.831589075191649e-38], [1.2243279161456126e-38, 4.1071675754097026e-38, 5.1871108851812044]])
forces =  [[ 4.92421768e-33 -2.84299840e-33  2.13120260e-32]
 [-4.92421768e-33  2.84299840e-33 -2.13120260e-32]]
stress =  [ 2.04987645e-11  2.04987645e-11  1.12242363e-11  5.36583783e-35
 -3.09796792e-35  1.01959410e-26]
energy per atom =  -1.5100011622233378
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0