element(s):
['C']
AFLOW prototype label:
A_hP4_194_bc
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.4677', '3.3769097']
model name:
MEAM_LAMMPS_KimLee_2008_TiC__MO_134206624109_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'C']
representative atom coordinates =  [[0.         0.         0.25      ]
 [0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[2.4677, 0, 0], [-1.23385, 2.1370908889189, 0], [0, 0, 8.3332]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:28:47      -29.492329         0.342484
BFGS:    1 15:28:47      -29.495654         0.272358
BFGS:    2 15:28:47      -29.502304         0.145239
BFGS:    3 15:28:47      -29.502643         0.145198
BFGS:    4 15:28:47      -29.509932         0.143319
BFGS:    5 15:28:47      -29.517044         0.139613
BFGS:    6 15:28:47      -29.523906         0.133783
BFGS:    7 15:28:47      -29.530413         0.125473
BFGS:    8 15:28:47      -29.536433         0.114267
BFGS:    9 15:28:47      -29.541811         0.099694
BFGS:   10 15:28:47      -29.546366         0.081222
BFGS:   11 15:28:47      -29.549889         0.058256
BFGS:   12 15:28:47      -29.552137         0.030137
BFGS:   13 15:28:47      -29.552833         0.004014
BFGS:   14 15:28:47      -29.552843         0.002060
BFGS:   15 15:28:47      -29.552844         0.000922
BFGS:   16 15:28:47      -29.552844         0.000018
BFGS:   17 15:28:47      -29.552844         0.000001
BFGS:   18 15:28:47      -29.552844         0.000000
Minimization converged after 18 steps.
Maximum force component: 1.9369701269771556e-30 eV/Angstrom
Maximum stress component: 8.855876549895356e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C']
basis =  [[0.00000000e+00 1.80242467e-37 2.50000000e-01]
 [6.01467016e-37 0.00000000e+00 7.50000000e-01]
 [3.33333333e-01 6.66666667e-01 2.50000000e-01]
 [6.66666667e-01 3.33333333e-01 7.50000000e-01]]
cellpar =  Cell([[2.455401344086741, -2.9509341603535417e-18, -4.3284283164383746e-33], [-1.2277006720433705, 2.1264399404655743, -8.656900395319939e-33], [-1.3323139548404057e-32, -3.846177673918549e-32, 7.269024735030382]])
forces =  [[-1.29131342e-30  5.59155112e-31 -5.69099487e-64]
 [ 1.12989924e-30 -8.38732668e-31  2.27636918e-63]
 [ 1.93697013e-30 -1.11831022e-30  2.27637493e-63]
 [-1.93697013e-30  1.11831022e-30 -2.27637493e-63]]
stress =  [ 8.85587655e-10  8.85587655e-10 -1.57407739e-10  7.97427408e-34
 -4.60394985e-34  1.71508664e-25]
energy per atom =  -7.388210934128388
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0