element(s):
['Sn']
AFLOW prototype label:
A_cF8_227_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['6.7273']
model name:
MEAM_LAMMPS_KimJeonLee_2015_MgSn__MO_935641703527_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Sn']
representative atom coordinates =  [[0 0 0]]
spacegroup =  227
cell =  [[6.7273, 0, 0], [0, 6.7273, 0], [0, 0, 6.7273]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:32:47      -24.734598        0.8500
BFGS:    1 17:32:47      -24.765021        0.8201
BFGS:    2 17:32:47      -24.878484        0.6912
BFGS:    3 17:32:47      -24.971901        0.5527
BFGS:    4 17:32:47      -25.043806        0.4043
BFGS:    5 17:32:47      -25.092658        0.2453
BFGS:    6 17:32:47      -25.116837        0.0752
BFGS:    7 17:32:47      -25.119223        0.0037
BFGS:    8 17:32:47      -25.119228        0.0001
BFGS:    9 17:32:47      -25.119228        0.0000
BFGS:   10 17:32:47      -25.119228        0.0000
Minimization converged after 10 steps.
Maximum force component: 3.6659592161961186e-31 eV/Angstrom
Maximum stress component: 8.960218814670505e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Sn', 'Sn', 'Sn', 'Sn', 'Sn', 'Sn', 'Sn', 'Sn']
basis =  [[3.91636558e-33 1.02720905e-33 2.74148305e-33]
 [3.84591936e-34 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 2.61178505e-33]
 [5.00000000e-01 4.39254759e-33 5.00000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]]
cellpar =  Cell([[6.489118814240423, -2.2138248823466688e-33, -6.713593142033525e-34], [-1.100110389832874e-33, 6.489118814240423, 8.993769142671148e-18], [-3.957660344099353e-34, 8.993769142671147e-18, 6.489118814240423]])
forces =  [[-9.99807059e-32  3.66595922e-31  5.74889059e-32]
 [ 3.33269020e-32  1.19976847e-31 -3.33269020e-32]
 [ 9.33153255e-32  8.33172549e-32  1.99961412e-32]
 [ 1.08312431e-31  2.26622933e-31 -9.33153255e-32]
 [-3.99922824e-32 -3.33269020e-32  2.83278667e-32]
 [-6.41542863e-32  3.99922824e-32 -1.99961412e-31]
 [ 5.87386647e-32  6.57960186e-32 -3.91591098e-32]
 [-2.66615216e-32 -1.59969129e-31 -3.99922824e-32]]
stress =  [-8.96021881e-15 -8.96021881e-15 -8.96021881e-15 -8.27646602e-31
 -4.87862860e-35  1.26584752e-51]
energy per atom =  -3.139903559385078
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0