element(s):
['Mo']
AFLOW prototype label:
A_hP1_191_a
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:
['2.7779', '0.90949998']
model name:
Morse_Shifted_GirifalcoWeizer_1959HighCutoff_Mo__MO_666830945336_004
==== Building ASE atoms object with: ====
representative atom symbols =  ['Mo']
representative atom coordinates =  [[0 0 0]]
spacegroup =  191
cell =  [[2.7779, 0, 0], [-1.38895, 2.4057319691728, 0], [0, 0, 2.5265]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:30:22       -5.670168         4.121918
BFGS:    1 15:30:22       -5.757939         0.841062
BFGS:    2 15:30:22       -5.764057         0.156054
BFGS:    3 15:30:22       -5.764250         0.006093
BFGS:    4 15:30:22       -5.764250         0.000111
BFGS:    5 15:30:22       -5.764250         0.000000
BFGS:    6 15:30:22       -5.764250         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.4015546901862637e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Mo']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[2.7435020076887926, 1.2263645056860366e-17, -1.8363418014155586e-40], [-1.3717510038443963, 2.3759424339921047, 2.604388694777295e-39], [-2.3295011723207979e-35, 1.3663154488352495e-35, 2.627131564287993]])
forces =  [[0. 0. 0.]]
stress =  [-5.19893197e-14 -5.19893197e-14  1.40155469e-12  1.87347196e-47
  5.93584625e-48 -1.86919898e-29]
energy per atom =  -5.764249913817024
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0