element(s):
['C']
AFLOW prototype label:
A_hP4_194_f
Parameter names:
['a', 'c/a', 'z1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.5124', '1.6642254', '0.062750617']
model name:
MEAM_LAMMPS_AgrawalMirzaeifar_2021_CuC__MO_028979335952_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['C']
representative atom coordinates =  [[0.33333333 0.66666667 0.06275062]]
spacegroup =  194
cell =  [[2.5124, 0, 0], [-1.2562, 2.175802224468, 0], [0, 0, 4.1812]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 14:30:33      -25.303467        18.668766
BFGS:    1 14:30:33      -28.048354         4.418105
BFGS:    2 14:30:33      -28.265682         1.549459
BFGS:    3 14:30:34      -28.314969         0.764314
BFGS:    4 14:30:34      -28.347925         0.308248
BFGS:    5 14:30:34      -28.349482         0.085875
BFGS:    6 14:30:34      -28.349723         0.051385
BFGS:    7 14:30:34      -28.349871         0.061642
BFGS:    8 14:30:34      -28.349964         0.044004
BFGS:    9 14:30:34      -28.349983         0.012437
BFGS:   10 14:30:34      -28.349984         0.001026
BFGS:   11 14:30:34      -28.349984         0.000048
BFGS:   12 14:30:34      -28.349984         0.000005
BFGS:   13 14:30:34      -28.349984         0.000000
BFGS:   14 14:30:34      -28.349984         0.000000
BFGS:   15 14:30:34      -28.349984         0.000000
Minimization converged after 15 steps.
Maximum force component: 2.339833085911094e-09 eV/Angstrom
Maximum stress component: 6.666417327685698e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C']
basis =  [[0.33333333 0.66666667 0.07393481]
 [0.66666666 0.33333334 0.57393481]
 [0.66666666 0.33333334 0.92606519]
 [0.33333333 0.66666667 0.42606519]]
cellpar =  Cell([[2.487093509373032, 4.510739763966554e-18, 2.1507729928981776e-36], [-1.243546754686516, 2.153886160704436, -7.359282107432456e-36], [-4.510255440688532e-36, -5.768648960151611e-35, 4.355434227577714]])
forces =  [[-1.83934766e-31 -3.53982622e-32  2.33983309e-09]
 [-1.02185981e-31  3.53982622e-32  2.33983309e-09]
 [ 5.10929906e-32 -8.84956555e-32 -2.33983309e-09]
 [-6.13115887e-32  1.06194787e-31 -2.33983309e-09]]
stress =  [-6.91979000e-11 -6.91979000e-11 -6.66641733e-10  2.62782385e-33
  1.51717481e-33  1.60076251e-26]
energy per atom =  -7.087496008322556
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0