element(s):
['Y']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.0551']
model name:
MEAM_LAMMPS_KimJeonLee_2015_MgY__MO_018428823000_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Y']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[5.0551, 0, 0], [0, 5.0551, 0], [0, 0, 5.0551]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:37:46      -17.303104         0.352384
BFGS:    1 15:37:46      -17.308140         0.314585
BFGS:    2 15:37:46      -17.328588         0.015260
BFGS:    3 15:37:46      -17.328639         0.000711
BFGS:    4 15:37:46      -17.328639         0.000002
BFGS:    5 15:37:46      -17.328639         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 5.877717538140627e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Y', 'Y', 'Y', 'Y']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [4.01130902e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[5.117240503180865, -1.1234641753493184e-32, -3.4241930976069606e-35], [-8.424471642673262e-33, 5.117240503180865, 2.447837374784178e-19], [-7.586903912554257e-33, 2.447837374784247e-19, 5.117240503180865]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-5.87771754e-12 -5.87771754e-12 -5.87771754e-12 -4.40968237e-28
 -9.80635396e-36 -3.26321105e-52]
energy per atom =  -4.332159692035012
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0