element(s):
['Be']
AFLOW prototype label:
A_hP2_194_c
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:
['2.2635', '1.5770267']
model name:
EAM_Dynamo_AgrawalMishraWard_2013_Be__MO_404563086984_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Be']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[2.2635, 0, 0], [-1.13175, 1.9602485014661, 0], [0, 0, 3.5696]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:47:52       -6.238267        2.1933
BFGS:    1 14:47:52       -6.338546        1.5781
BFGS:    2 14:47:52       -6.435115        0.6272
BFGS:    3 14:47:52       -6.450634        0.1106
BFGS:    4 14:47:52       -6.451061        0.0539
BFGS:    5 14:47:52       -6.451135        0.0485
BFGS:    6 14:47:52       -6.451386        0.0021
BFGS:    7 14:47:52       -6.451386        0.0001
BFGS:    8 14:47:52       -6.451386        0.0000
BFGS:    9 14:47:52       -6.451386        0.0000
Minimization converged after 9 steps.
Maximum force component: 6.211772193468542e-32 eV/Angstrom
Maximum stress component: 1.4134847940460662e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Be', 'Be']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[2.3328594985397384, 1.0111362237507373e-17, -2.1152139129445495e-37], [-1.1664297492698692, 2.0203155891952402, -1.0417896834713946e-36], [2.5731994822785712e-36, -1.0914407969252434e-36, 3.7796912397750826]])
forces =  [[ 4.22895099e-68 -1.79373953e-68  6.21177219e-32]
 [-4.22895099e-68  1.79373953e-68 -6.21177219e-32]]
stress =  [ 1.41348479e-10  1.41348479e-10  1.54737550e-11 -8.07076914e-34
  4.65966074e-34 -4.29689966e-26]
energy per atom =  -17409.382802876633
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0