element(s):
['C']
AFLOW prototype label:
A_cI8_214_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.1243']
model name:
MEAM_LAMMPS_NouranianTschoppGwaltney_2014_CH__MO_354152387712_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['C']
representative atom coordinates =  [[0.125 0.125 0.125]]
spacegroup =  214
cell =  [[4.1243, 0, 0], [0, 4.1243, 0], [0, 0, 4.1243]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:31:15      -46.851396         0.998980
BFGS:    1 16:31:15      -46.893449         0.965426
BFGS:    2 16:31:15      -47.029235         0.844041
BFGS:    3 16:31:15      -47.146356         0.716537
BFGS:    4 16:31:15      -47.243879         0.582697
BFGS:    5 16:31:15      -47.320837         0.442295
BFGS:    6 16:31:15      -47.376228         0.295100
BFGS:    7 16:31:15      -47.409015         0.140873
BFGS:    8 16:31:15      -47.418301         0.006355
BFGS:    9 16:31:15      -47.418319         0.000128
BFGS:   10 16:31:15      -47.418319         0.000000
BFGS:   11 16:31:15      -47.418319         0.000000
Minimization converged after 11 steps.
Maximum force component: 8.128269214551703e-32 eV/Angstrom
Maximum stress component: 2.496515604332665e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[0.125 0.125 0.125]
 [0.375 0.875 0.625]
 [0.875 0.625 0.375]
 [0.625 0.375 0.875]
 [0.875 0.375 0.125]
 [0.625 0.625 0.625]
 [0.375 0.125 0.875]
 [0.125 0.875 0.375]]
cellpar =  Cell([[3.9397327148697463, -1.057881463436255e-32, 4.3331698796723575e-33], [1.958743936411719e-33, 3.9397327148697463, 5.997159669170689e-18], [9.274944027200667e-33, 5.9971596691706954e-18, 3.9397327148697463]])
forces =  [[-4.04674624e-33  2.42804775e-32  2.83272237e-32]
 [-8.09349249e-33 -1.61869850e-32  1.61869850e-32]
 [ 8.12826921e-32  3.23739700e-32  4.85609549e-32]
 [ 4.85609549e-32  4.85609549e-32 -2.42804775e-32]
 [-1.86404043e-65 -5.66544474e-32  4.04674624e-33]
 [ 1.61869850e-32  1.41636119e-32  1.16343955e-32]
 [ 5.26077012e-32  2.52921640e-32 -5.66544474e-32]
 [ 8.09349249e-33 -4.85609549e-32 -5.56427609e-32]]
stress =  [-2.49651560e-13 -2.49651560e-13 -2.49651560e-13  1.23389589e-28
 -1.32353580e-34  6.70414758e-50]
energy per atom =  -5.92728991412539
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0