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:
MEAM_LAMMPS_WeiZhouLi_2019_BeO__MO_344044439515_002
==== 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 14:48:04       -6.801262        0.6107
BFGS:    1 14:48:04       -6.807794        0.5322
BFGS:    2 14:48:04       -6.828122        0.1161
BFGS:    3 14:48:04       -6.828978        0.0239
BFGS:    4 14:48:04       -6.829001        0.0191
BFGS:    5 14:48:04       -6.829029        0.0164
BFGS:    6 14:48:04       -6.829055        0.0085
BFGS:    7 14:48:04       -6.829064        0.0034
BFGS:    8 14:48:04       -6.829065        0.0007
BFGS:    9 14:48:04       -6.829065        0.0000
BFGS:   10 14:48:04       -6.829065        0.0000
BFGS:   11 14:48:04       -6.829065        0.0000
BFGS:   12 14:48:04       -6.829065        0.0000
Minimization converged after 12 steps.
Maximum force component: 2.4459919842506698e-32 eV/Angstrom
Maximum stress component: 1.2938222904568277e-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([[2.29141598364333, 1.3459669598759383e-18, 2.6551568426938013e-37], [-1.145707991821665, 1.9844244524728316, 1.0821149923721895e-39], [-6.073705460707125e-37, -1.025097639985625e-36, 3.7024497967956624]])
forces =  [[ 4.70731377e-33 -2.44599198e-32 -7.60603619e-33]
 [ 1.41219413e-32 -8.15330661e-33  7.60603619e-33]]
stress =  [-2.51871667e-12 -2.51871667e-12 -1.29382229e-10  4.47368543e-33
 -3.15706494e-47  3.14527038e-28]
energy per atom =  -3.4145325630564822
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0