element(s):
['Al']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.039']
model name:
Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[4.039, 0, 0], [0, 4.039, 0], [0, 0, 4.039]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:12:43      -13.410923         0.066255
BFGS:    1 16:12:43      -13.411103         0.060412
BFGS:    2 16:12:43      -13.412000         0.000962
BFGS:    3 16:12:43      -13.412000         0.000014
BFGS:    4 16:12:43      -13.412000         0.000000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.8623607270385727e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al', 'Al', 'Al']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 9.28785848e-38]]
cellpar =  Cell([[4.049999180432504, -1.367267172914604e-33, 4.077020153600717e-33], [-9.588622853150485e-34, 4.049999180432504, 5.824305509890566e-21], [-2.8121450698066006e-33, 5.824305509890673e-21, 4.049999180432504]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.86236073e-10 -1.86236073e-10 -1.86236073e-10 -1.63499927e-26
 -1.17416901e-35 -1.60116083e-53]
energy per atom =  -3.3530000141821508
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0