element(s):
['Ag', 'O']
AFLOW prototype label:
A2B3_cP10_224_b_d
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.1886']
model name:
Sim_LAMMPS_MEAM_GaoOterodelaRozaAouadi_2013_AgTaO__SM_485325656366_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ag', 'O']
representative atom coordinates =  [[0.25 0.25 0.25]
 [0.   0.5  0.5 ]]
spacegroup =  224
cell =  [[5.1886, 0, 0], [0, 5.1886, 0], [0, 0, 5.1886]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:35:30      -35.279399         1.015231
BFGS:    1 16:35:30      -35.322624         0.971500
BFGS:    2 16:35:30      -35.456671         0.814046
BFGS:    3 16:35:31      -35.566300         0.645841
BFGS:    4 16:35:31      -35.649860         0.466364
BFGS:    5 16:35:31      -35.705619         0.275082
BFGS:    6 16:35:31      -35.731766         0.071435
BFGS:    7 16:35:31      -35.733573         0.003039
BFGS:    8 16:35:31      -35.733576         0.000031
BFGS:    9 16:35:32      -35.733576         0.000000
BFGS:   10 16:35:32      -35.733576         0.000000
Minimization converged after 10 steps.
Maximum force component: 9.944828667830939e-31 eV/Angstrom
Maximum stress component: 4.075054349953228e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ag', 'Ag', 'Ag', 'Ag', 'O', 'O', 'O', 'O', 'O', 'O']
basis =  [[0.25 0.25 0.25]
 [0.75 0.75 0.25]
 [0.75 0.25 0.75]
 [0.25 0.75 0.75]
 [1.   0.5  0.5 ]
 [0.5  1.   0.5 ]
 [0.5  0.5  1.  ]
 [1.   0.5  1.  ]
 [0.5  1.   1.  ]
 [1.   1.   0.5 ]]
cellpar =  Cell([[5.042627211977117, 1.6018594641091602e-32, -1.5091275359520212e-33], [-9.499598962726491e-33, 5.042627211977117, 4.427461520179329e-17], [-9.991394905880052e-33, 4.42746152017933e-17, 5.042627211977117]])
forces =  [[-3.31494289e-31 -6.62988578e-31 -6.62988578e-31]
 [-4.97241433e-31  9.94482867e-31  9.94482867e-31]
 [-7.87298936e-31 -4.97241433e-31 -9.11609295e-31]
 [ 6.24488520e-64 -3.31494289e-31 -2.91054275e-48]
 [-4.97241433e-31 -4.97241433e-31 -3.31494289e-31]
 [-3.31494289e-31 -3.31494289e-31  6.62988578e-31]
 [ 7.45862150e-31 -5.80115006e-31 -4.97241433e-31]
 [-9.94482867e-31 -3.31494289e-31 -6.62988578e-31]
 [-4.14367861e-31  6.62988578e-31 -9.94482867e-31]
 [-6.62988578e-31  4.97241433e-31 -3.31494289e-31]]
stress =  [-4.07505435e-15 -4.07505435e-15 -4.07505435e-15 -6.58098152e-31
 -3.61103606e-63  8.73404245e-64]
energy per atom =  -3.5733575749936106
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0