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:
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002
==== 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 15:11:42      -13.410923         0.066255
BFGS:    1 15:11:42      -13.411103         0.060412
BFGS:    2 15:11:42      -13.412000         0.000962
BFGS:    3 15:11:42      -13.412000         0.000014
BFGS:    4 15:11:42      -13.412000         0.000000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.8623554891711015e-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 4.75538354e-35]]
cellpar =  Cell([[4.049999180432505, -3.640156397308934e-33, 3.9914403412492154e-34], [-5.8337270444899746e-33, 4.049999180432505, -2.1930851842233107e-18], [5.452046573098502e-35, -2.1930851842233115e-18, 4.049999180432505]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.86235549e-10 -1.86235549e-10 -1.86235549e-10 -1.08845484e-27
  5.87084507e-36 -3.24440874e-53]
energy per atom =  -3.35300001418215
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0