element(s):
['Mo']
AFLOW prototype label:
A_hP4_194_ac
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:
['2.7695', '3.5762773']
model name:
MEAM_LAMMPS_LeeBaskesKim_2001_Mo__MO_805823015127_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Mo', 'Mo']
representative atom coordinates =  [[0.         0.         0.        ]
 [0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[2.7695, 0, 0], [-1.38475, 2.398457355781, 0], [0, 0, 9.9045]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:10:21      -26.446395         1.434659
BFGS:    1 16:10:21      -26.476545         1.264009
BFGS:    2 16:10:21      -26.529831         0.855119
BFGS:    3 16:10:21      -26.561467         0.455306
BFGS:    4 16:10:21      -26.581129         0.644933
BFGS:    5 16:10:21      -26.599882         0.691350
BFGS:    6 16:10:21      -26.623704         0.568526
BFGS:    7 16:10:21      -26.646146         0.228634
BFGS:    8 16:10:21      -26.649991         0.058240
BFGS:    9 16:10:21      -26.650165         0.006075
BFGS:   10 16:10:21      -26.650168         0.000489
BFGS:   11 16:10:21      -26.650168         0.000054
BFGS:   12 16:10:21      -26.650168         0.000003
BFGS:   13 16:10:21      -26.650168         0.000000
BFGS:   14 16:10:21      -26.650168         0.000000
Minimization converged after 14 steps.
Maximum force component: 7.513302865167555e-32 eV/Angstrom
Maximum stress component: 8.565931272819121e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Mo', 'Mo', 'Mo', 'Mo']
basis =  [[0.         0.         0.        ]
 [0.         0.         0.5       ]
 [0.33333333 0.66666667 0.25      ]
 [0.66666667 0.33333333 0.75      ]]
cellpar =  Cell([[2.8339276639951096, -1.751203035986854e-17, 6.345472754095867e-34], [-1.4169638319975548, 2.4542533495072556, 1.2691778967269979e-33], [2.180097481113914e-33, 6.281000246461402e-33, 9.143273171257082]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [-1.79145174e-65 -5.16128702e-65 -7.51330287e-32]
 [ 2.91090461e-33  5.04183468e-33  7.51330287e-32]]
stress =  [-8.56593127e-12 -8.56593127e-12  7.00411413e-12 -2.51756572e-34
 -3.96413795e-35 -1.36565546e-27]
energy per atom =  -6.66254209096006
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0