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_ParkFellingerLenosky_2012_Mo__MO_269937397263_002
==== 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 15:20:02      -25.259925        2.6285
BFGS:    1 15:20:02      -25.413537        2.1349
BFGS:    2 15:20:02      -25.549715        1.3999
BFGS:    3 15:20:02      -25.611148        0.6131
BFGS:    4 15:20:02      -25.619908        0.4043
BFGS:    5 15:20:02      -25.627753        0.4242
BFGS:    6 15:20:02      -25.646276        0.2464
BFGS:    7 15:20:02      -25.649909        0.0670
BFGS:    8 15:20:02      -25.650140        0.0080
BFGS:    9 15:20:02      -25.650142        0.0013
BFGS:   10 15:20:02      -25.650142        0.0001
BFGS:   11 15:20:02      -25.650142        0.0000
BFGS:   12 15:20:02      -25.650142        0.0000
BFGS:   13 15:20:02      -25.650142        0.0000
Minimization converged after 13 steps.
Maximum force component: 9.54297362596494e-32 eV/Angstrom
Maximum stress component: 4.4053622245333164e-10 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([[2.7528417676333663, -1.548312298815629e-17, 2.768711184012253e-35], [-1.3764208838166831, 2.384030903369355, 5.17248240431456e-35], [9.337632832908463e-35, 3.0912129527239672e-34, 9.290615996095964]])
forces =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [9.59126756e-67 3.17517845e-66 9.54297363e-32]
 [0.00000000e+00 0.00000000e+00 0.00000000e+00]]
stress =  [ 1.96795980e-10  1.96795980e-10  4.40536222e-10 -9.73872536e-34
 -4.01618265e-34 -4.99905556e-26]
energy per atom =  -6.412535591431975
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0