element(s):
['C']
AFLOW prototype label:
A_cI16_229_f
Parameter names:
['a', 'x1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.8764', '0.16261302']
model name:
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['C']
representative atom coordinates =  [[0.16261302 0.16261302 0.16261302]]
spacegroup =  229
cell =  [[4.8764, 0, 0], [0, 4.8764, 0], [0, 0, 4.8764]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 18:18:02      -79.330335         2.919360
BFGS:    1 18:18:02      -79.562109         2.669350
BFGS:    2 18:18:02      -80.056098         2.529800
BFGS:    3 18:18:02      -80.455167         2.385788
BFGS:    4 18:18:02      -80.818423         2.243308
BFGS:    5 18:18:02      -81.155902         2.104014
BFGS:    6 18:18:02      -81.470788         1.968412
BFGS:    7 18:18:02      -81.764527         1.836619
BFGS:    8 18:18:02      -82.038016         1.708617
BFGS:    9 18:18:02      -82.291952         1.584340
BFGS:   10 18:18:02      -82.526954         1.463708
BFGS:   11 18:18:03      -82.743602         1.346634
BFGS:   12 18:18:03      -82.942449         1.233029
BFGS:   13 18:18:03      -83.124031         1.122804
BFGS:   14 18:18:03      -83.288868         1.015876
BFGS:   15 18:18:03      -83.437468         0.912166
BFGS:   16 18:18:03      -83.570321         0.811578
BFGS:   17 18:18:03      -83.687912         0.714146
BFGS:   18 18:18:03      -83.790769         0.620146
BFGS:   19 18:18:03      -83.879455         0.529531
BFGS:   20 18:18:03      -83.954498         0.442217
BFGS:   21 18:18:03      -84.016396         0.358120
BFGS:   22 18:18:03      -84.065626         0.277157
BFGS:   23 18:18:03      -84.102644         0.199256
BFGS:   24 18:18:03      -84.127892         0.124355
BFGS:   25 18:18:03      -84.141791         0.052418
BFGS:   26 18:18:03      -84.145006         0.011889
BFGS:   27 18:18:03      -84.145016         0.006904
BFGS:   28 18:18:04      -84.145019         0.002388
BFGS:   29 18:18:04      -84.145020         0.000164
BFGS:   30 18:18:04      -84.145020         0.000035
BFGS:   31 18:18:04      -84.145020         0.000004
BFGS:   32 18:18:04      -84.145020         0.000000
BFGS:   33 18:18:04      -84.145020         0.000000
Minimization converged after 33 steps.
Maximum force component: 3.380115770612591e-10 eV/Angstrom
Maximum stress component: 6.485367376715249e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[0.16221069 0.16221069 0.16221069]
 [0.83778931 0.83778931 0.16221069]
 [0.83778931 0.16221069 0.83778931]
 [0.16221069 0.83778931 0.83778931]
 [0.16221069 0.16221069 0.83778931]
 [0.83778931 0.83778931 0.83778931]
 [0.16221069 0.83778931 0.16221069]
 [0.83778931 0.16221069 0.16221069]
 [0.66221069 0.66221069 0.66221069]
 [0.33778931 0.33778931 0.66221069]
 [0.33778931 0.66221069 0.33778931]
 [0.66221069 0.33778931 0.33778931]
 [0.66221069 0.66221069 0.33778931]
 [0.33778931 0.33778931 0.33778931]
 [0.66221069 0.33778931 0.66221069]
 [0.33778931 0.66221069 0.66221069]]
cellpar =  Cell([[5.266514072001747, 1.995514528823416e-32, -4.2207289707931014e-32], [-3.735423114682151e-32, 5.266514072001747, -2.078952817532127e-17], [9.907799213285344e-33, -2.0789528175321307e-17, 5.266514072001747]])
forces =  [[ 3.38011577e-10  3.38011577e-10  3.38011577e-10]
 [-3.38011577e-10 -3.38011577e-10  3.38011577e-10]
 [-3.38011577e-10  3.38011577e-10 -3.38011577e-10]
 [ 3.38011577e-10 -3.38011577e-10 -3.38011577e-10]
 [ 3.38011577e-10  3.38011577e-10 -3.38011577e-10]
 [-3.38011577e-10 -3.38011577e-10 -3.38011577e-10]
 [ 3.38011577e-10 -3.38011577e-10  3.38011577e-10]
 [-3.38011577e-10  3.38011577e-10  3.38011577e-10]
 [ 3.38011577e-10  3.38011577e-10  3.38011577e-10]
 [-3.38011577e-10 -3.38011577e-10  3.38011577e-10]
 [-3.38011577e-10  3.38011577e-10 -3.38011577e-10]
 [ 3.38011577e-10 -3.38011577e-10 -3.38011577e-10]
 [ 3.38011577e-10  3.38011577e-10 -3.38011577e-10]
 [-3.38011577e-10 -3.38011577e-10 -3.38011577e-10]
 [ 3.38011577e-10 -3.38011577e-10  3.38011577e-10]
 [-3.38011577e-10  3.38011577e-10  3.38011577e-10]]
stress =  [-6.48536738e-11 -6.48536738e-11 -6.48536738e-11  1.52252273e-26
  2.96266606e-33 -3.42057774e-49]
energy per atom =  -5.2590637330024945
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0