element(s):
['Y']
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:
['3.6555', '1.5493093']
model name:
MEAM_LAMMPS_AhmadGrohGhazisaeidi_2018_MgY__MO_135739722270_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Y']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[3.6555, 0, 0], [-1.82775, 3.165755863534, 0], [0, 0, 5.6635]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:17:17       -8.735336         0.419252
BFGS:    1 15:17:17       -8.737792         0.359793
BFGS:    2 15:17:17       -8.744448         0.094775
BFGS:    3 15:17:17       -8.744804         0.095705
BFGS:    4 15:17:17       -8.745747         0.063269
BFGS:    5 15:17:17       -8.746054         0.027643
BFGS:    6 15:17:17       -8.746126         0.007527
BFGS:    7 15:17:17       -8.746129         0.000662
BFGS:    8 15:17:17       -8.746129         0.000035
BFGS:    9 15:17:17       -8.746129         0.000001
BFGS:   10 15:17:17       -8.746129         0.000000
BFGS:   11 15:17:17       -8.746129         0.000000
Minimization converged after 11 steps.
Maximum force component: 2.010196921097846e-32 eV/Angstrom
Maximum stress component: 7.801008223604568e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Y', 'Y']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[3.641002032018394, 7.692276882746468e-18, 3.3289376381080806e-38], [-1.820501016009197, 3.1532002549586906, 5.608215963897452e-38], [8.949074596013728e-37, 4.5507843578138776e-36, 5.82029226251087]])
forces =  [[ 2.01019692e-32 -8.90683609e-33 -5.97838675e-33]
 [-2.01019692e-32  8.90683609e-33  5.97838675e-33]]
stress =  [-2.49039622e-12 -2.49039622e-12 -7.80100822e-12  2.23873588e-34
  9.69401070e-35  1.43684145e-27]
energy per atom =  -4.3730647455266975
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0