element(s):
['He']
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:
['2.8848', '1.635122']
model name:
EAM_Dynamo_BonnyGrigorevTerentyev_2014EAM1_WHHe__MO_292520929154_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['He']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[2.8848, 0, 0], [-1.4424, 2.4983100848373, 0], [0, 0, 4.717]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:58:19       -0.003938        0.0504
BFGS:    1 14:58:19       -0.004046        0.0513
BFGS:    2 14:58:19       -0.013717        0.1157
BFGS:    3 14:58:19       -0.038734        0.2311
BFGS:    4 14:58:19       -0.083641        0.3860
BFGS:    5 14:58:19       -0.154261        0.5803
BFGS:    6 14:58:19       -0.256427        0.8141
BFGS:    7 14:58:19       -0.395983        1.0874
BFGS:    8 14:58:19       -0.578785        1.4001
BFGS:    9 14:58:19       -0.810705        1.7523
BFGS:   10 14:58:19       -1.097635        2.1440
BFGS:   11 14:58:19       -1.445485        2.5751
BFGS:   12 14:58:19       -1.860192        3.0460
BFGS:   13 14:58:19       -2.349652        3.5905
BFGS:   14 14:58:19       -2.926343        4.1821
BFGS:   15 14:58:19       -3.581376        4.5720
BFGS:   16 14:58:19       -4.272131        4.7239
BFGS:   17 14:58:19       -4.949988        4.6259
BFGS:   18 14:58:19       -5.578508        4.3662
BFGS:   19 14:58:19       -6.153077        4.0368
BFGS:   20 14:58:19       -6.699425        3.7074
BFGS:   21 14:58:19       -7.249449        3.7557
BFGS:   22 14:58:19       -7.833887        4.2164
BFGS:   23 14:58:19       -8.513374        4.9346
BFGS:   24 14:58:19       -9.287256        5.8066
BFGS:   25 14:58:19      -10.239221        7.3401
BFGS:   26 14:58:19      -11.496109        9.9040
BFGS:   27 14:58:19      -13.111365       12.5389
BFGS:   28 14:58:19      -15.220302       15.9136
BFGS:   29 14:58:19      -17.659428       18.4414
BFGS:   30 14:58:19      -20.843765       25.1927
BFGS:   31 14:58:19      -25.347161       36.8543
BFGS:   32 14:58:19      -31.665950       51.5538
BFGS:   33 14:58:19      -40.914871       78.7784
BFGS:   34 14:58:19      -53.851408      120.0603
BFGS:   35 14:58:19      -71.742808      190.3789
BFGS:   36 14:58:19      -82.461965      233.1409
BFGS:   37 14:58:19     -105.907859      342.2588
BFGS:   38 14:58:19     -146.556360      587.0602
BFGS:   39 14:58:19     -226.478368     1175.1025
Minimization stalled after 39 steps.
Maximum force component: 2.2412724006715914e-30 eV/Angstrom
Maximum stress component: 4250.147740759011 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['He', 'He']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[0.26635784099871634, 5.500431024814509e-17, -6.208765021532406e-34], [-0.13317892049935817, 0.23067265680205817, -1.4260884130656806e-33], [1.1606530957974818e-32, -2.4185215714288233e-32, 0.8415196675066295]])
forces =  [[ 2.24127240e-30 -1.94099884e-30 -1.10640328e-31]
 [-2.24127240e-30  1.94099884e-30  1.10640328e-31]]
stress =  [ 4.19691006e+03  4.19691006e+03  4.25014774e+03 -2.27684524e-26
 -7.98806867e-27 -3.32288465e-13]
energy per atom =  -113.23918380833229
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0