element(s):
['C']
AFLOW prototype label:
A_hP8_194_ef
Parameter names:
['a', 'c/a', 'z1', 'z2']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.5188', '3.2978799', '0.092975226', '0.65554043']
model name:
MEAM_LAMMPS_JeongLee_2020_PdC__MO_068985622065_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'C']
representative atom coordinates =  [[0.         0.         0.09297523]
 [0.33333333 0.66666667 0.65554043]]
spacegroup =  194
cell =  [[2.5188, 0, 0], [-1.2594, 2.1813447870522, 0], [0, 0, 8.3067]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 14:47:38      -58.624144         3.195021
BFGS:    1 14:47:38      -58.626724         2.190544
BFGS:    2 14:47:38      -58.775603         0.904455
BFGS:    3 14:47:38      -58.791662         0.678798
BFGS:    4 14:47:38      -58.800951         0.348471
BFGS:    5 14:47:38      -58.802776         0.307359
BFGS:    6 14:47:38      -58.810452         0.055376
BFGS:    7 14:47:38      -58.810543         0.013319
BFGS:    8 14:47:38      -58.810557         0.006471
BFGS:    9 14:47:38      -58.810558         0.005962
BFGS:   10 14:47:38      -58.810563         0.003967
BFGS:   11 14:47:38      -58.810565         0.002682
BFGS:   12 14:47:38      -58.810565         0.000533
BFGS:   13 14:47:38      -58.810565         0.000043
BFGS:   14 14:47:38      -58.810565         0.000001
BFGS:   15 14:47:38      -58.810565         0.000000
BFGS:   16 14:47:38      -58.810565         0.000000
Minimization converged after 16 steps.
Maximum force component: 4.607773662623771e-09 eV/Angstrom
Maximum stress component: 2.0400571626053138e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[0.00000000e+00 0.00000000e+00 9.04661405e-02]
 [0.00000000e+00 4.55797896e-35 5.90466140e-01]
 [2.00576855e-35 5.18853722e-35 9.09533860e-01]
 [2.69014379e-35 3.22657678e-36 4.09533860e-01]
 [3.33333333e-01 6.66666667e-01 6.58174220e-01]
 [6.66666667e-01 3.33333333e-01 1.58174220e-01]
 [6.66666667e-01 3.33333333e-01 3.41825780e-01]
 [3.33333333e-01 6.66666667e-01 8.41825780e-01]]
cellpar =  Cell([[2.514064028077973, -1.5279373498510005e-19, -9.092637451718134e-37], [-1.2570320140389866, 2.1772433150561574, -1.7559847321394372e-36], [-7.464675744145598e-36, -9.013781271132562e-36, 8.241561439771138]])
forces =  [[ 1.75599979e-31 -1.78910639e-32 -4.60777366e-09]
 [ 4.17801191e-45  1.43128511e-31 -4.60777366e-09]
 [-2.89223495e-31 -7.15642555e-32  4.60777366e-09]
 [ 2.27247032e-31 -7.15642555e-32  4.60777366e-09]
 [-8.26352844e-32 -1.43128511e-31 -5.22250639e-10]
 [ 1.85929390e-31  1.07346383e-31 -5.22250639e-10]
 [-8.26352844e-32  7.15642555e-32  5.22250639e-10]
 [-2.68564674e-31  3.22039150e-31  5.22250639e-10]]
stress =  [ 2.04005716e-10  2.04005716e-10 -1.99839053e-10 -7.78505447e-33
 -7.93182934e-34 -4.39653156e-26]
energy per atom =  -7.35132061835865
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0