element(s):
['C']
AFLOW prototype label:
A_cF8_227_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.5727']
model name:
EDIP_LAMMPS_Marks_2000_C__MO_374144505645_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['C']
representative atom coordinates =  [[0 0 0]]
spacegroup =  227
cell =  [[3.5727, 0, 0], [0, 3.5727, 0], [0, 0, 3.5727]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:25:49      -58.773249        0.0017
BFGS:    1 17:25:49      -58.773249        0.0015
BFGS:    2 17:25:49      -58.773250        0.0000
BFGS:    3 17:25:49      -58.773250        0.0000
Minimization converged after 3 steps.
Maximum force component: 1.5595830901979127e-31 eV/Angstrom
Maximum stress component: 2.289303758109209e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[1.79753461e-33 0.00000000e+00 0.00000000e+00]
 [6.03458049e-33 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [5.00000000e-01 1.60494162e-33 5.00000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]]
cellpar =  Cell([[3.5725669322905858, -1.1500555873069475e-33, -1.0872760079490737e-34], [1.1500555873220621e-33, 3.5725669322905858, 1.744281972979996e-40], [9.87734774309388e-35, 5.770611663144236e-40, 3.5725669322905858]])
forces =  [[-1.06418611e-31 -2.20176436e-32  1.46784291e-32]
 [-6.23833236e-32 -7.33921454e-32 -1.55958309e-31]
 [-5.87137163e-32 -2.93568582e-32 -5.87137163e-32]
 [ 4.40352873e-32 -3.94482782e-32  1.65132327e-32]
 [ 8.80705745e-32 -5.87137163e-32 -8.07313600e-32]
 [-8.80705745e-32 -2.93568582e-32  7.33921454e-32]
 [ 2.93568582e-32 -8.07313600e-32  1.43114684e-31]
 [-5.87137163e-32  5.50441091e-32  1.78689755e-66]]
stress =  [ 2.28930376e-12  2.28930376e-12  2.28930376e-12  3.21830265e-34
 -4.82869435e-33  5.43901936e-62]
energy per atom =  -7.346656256064827
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0