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_1959MedCutoff_Mo__MO_534363225491_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 15:30:21       -5.613764         4.198440
BFGS:    1 15:30:21       -5.704074         0.778223
BFGS:    2 15:30:21       -5.709352         0.147232
BFGS:    3 15:30:21       -5.709523         0.004625
BFGS:    4 15:30:21       -5.709524         0.000100
BFGS:    5 15:30:21       -5.709524         0.000000
BFGS:    6 15:30:21       -5.709524         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 6.892682631692023e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Mo']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[2.744972004587392, 1.3767417534457473e-17, 5.82371152741628e-42], [-1.372486002293696, 2.3772154886497763, -6.044240307363164e-42], [4.460979811607996e-41, -2.1001798541492584e-37, 2.6291196614463628]])
forces =  [[0. 0. 0.]]
stress =  [-5.28705846e-13 -5.28705846e-13  6.89268263e-11 -8.46156678e-48
 -2.91671122e-48 -6.77391790e-29]
energy per atom =  -5.7095236631913515
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0