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_KoLee_2013_VPdY__MO_046547823135_002
==== 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 17:24:17      -17.303108        0.3523
BFGS:    1 17:24:17      -17.308142        0.3145
BFGS:    2 17:24:17      -17.328588        0.0153
BFGS:    3 17:24:17      -17.328639        0.0007
BFGS:    4 17:24:17      -17.328639        0.0000
BFGS:    5 17:24:17      -17.328639        0.0000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 5.875142468336163e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Y', 'Y', 'Y', 'Y']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 2.20523888e-37]]
cellpar =  Cell([[5.1172441554962615, 7.496190007500225e-34, -1.1017678167185423e-33], [-1.555793852409561e-33, 5.1172441554962615, 1.146005320024566e-21], [-6.37338078974156e-33, 1.146005320030539e-21, 5.1172441554962615]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-5.87514247e-12 -5.87514247e-12 -5.87514247e-12  1.33965339e-27
  9.80633996e-36 -1.07445397e-51]
energy per atom =  -4.332159786920722
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0