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:
EAM_Dynamo_SmirnovaKuskinStarikov_2013_UMoXe__MO_679329885632_005
==== 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 17:53:07       -6.073154         1.799539
BFGS:    1 17:53:07       -6.141430         0.585696
BFGS:    2 17:53:07       -6.143351         0.166555
BFGS:    3 17:53:07       -6.143741         0.056530
BFGS:    4 17:53:07       -6.143859         0.025353
BFGS:    5 17:53:07       -6.143864         0.006048
BFGS:    6 17:53:07       -6.143864         0.000131
BFGS:    7 17:53:07       -6.143864         0.000003
BFGS:    8 17:53:07       -6.143864         0.000000
BFGS:    9 17:53:07       -6.143864         0.000000
Minimization converged after 9 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 9.49620556972871e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Mo']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[2.7035232542266185, -3.978589320754977e-18, -8.65406607587504e-37], [-1.3517616271133093, 2.3413198178822268, -1.7747075712454317e-36], [-5.957215951647717e-36, -5.139434870945645e-35, 2.4861403343558863]])
forces =  [[0. 0. 0.]]
stress =  [-9.36862171e-12 -9.36862171e-12  9.49620557e-11  4.35475651e-38
 -7.38128053e-38 -6.64190291e-28]
energy per atom =  -6.111702453662362
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0