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_LeeLee_2005_C__MO_996970420049_000
==== 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 10:57:16      -29.218159         4.167900
BFGS:    1 10:57:16      -29.156929         2.157678
BFGS:    2 10:57:16      -29.307107         1.404737
BFGS:    3 10:57:16      -29.215902         4.481741
BFGS:    4 10:57:16      -29.357829         0.880454
BFGS:    5 10:57:16      -29.370448         0.542495
BFGS:    6 10:57:16      -29.375274         0.243076
BFGS:    7 10:57:17      -29.376330         0.142166
BFGS:    8 10:57:17      -29.377608         0.008742
BFGS:    9 10:57:17      -29.377611         0.006808
BFGS:   10 10:57:17      -29.377614         0.005235
BFGS:   11 10:57:17      -29.377616         0.003348
BFGS:   12 10:57:17      -29.377616         0.001111
BFGS:   13 10:57:17      -29.377616         0.000132
BFGS:   14 10:57:17      -29.377616         0.000005
BFGS:   15 10:57:17      -29.377616         0.000000
BFGS:   16 10:57:17      -29.377616         0.000000
Minimization converged after 16 steps.
Maximum force component: 7.936904477395814e-09 eV/Angstrom
Maximum stress component: 1.4585189034361564e-09 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C']
basis =  [[0.33333333 0.66666667 0.06910118]
 [0.66666666 0.33333334 0.56910118]
 [0.66666666 0.33333334 0.93089882]
 [0.33333333 0.66666667 0.43089882]]
cellpar =  Cell([[2.513541622284189, 5.3381567620149546e-18, 1.4915616695717661e-36], [-1.2567708111420945, 2.176790898367657, -2.8371757365798514e-36], [-4.1563198898009016e-36, -1.3439436495693064e-35, 4.126373158711348]])
forces =  [[ 7.99450575e-45  4.29296310e-31 -7.93690448e-09]
 [-3.09817925e-32  5.36620387e-32 -7.93690448e-09]
 [-7.99450575e-45 -2.58501884e-44  7.93690448e-09]
 [-3.76945142e-31 -6.26057118e-32  7.93690448e-09]]
stress =  [-5.17868527e-10 -5.17868527e-10  1.45851890e-09  5.71773476e-33
  3.96136285e-34  2.00168339e-25]
energy per atom =  -7.344404039184026
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0